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Neopterin

Compound with spectra: 3 NMR, 4 FTIR, and 1 Raman

Neopterin
SpectraBase Compound ID 93vy1ftjPng
InChI InChI=1S/C9H11N5O4/c10-9-13-7-5(8(18)14-9)12-3(1-11-7)6(17)4(16)2-15/h1,4,6,15-17H,2H2,(H3,10,11,13,14,18)/t4-,6+/m1/s1
InChIKey BMQYVXCPAOLZOK-XINAWCOVSA-N
Mol Weight 253.22 g/mol
Molecular Formula C9H11N5O4
Exact Mass 253.081104 g/mol
Enantiomer InChIKey BMQYVXCPAOLZOK-UJURSFKZSA-N

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FTIR Spectrum
Copyright Copyright © 2012-2024 John Wiley & Sons, Inc. All Rights Reserved.
Source of Sample Cayman Chemical Company
Source of Spectrum Forensic Spectral Research
Catalog Number 12057
Technique KBr0

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FTIR Spectrum
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Source of Sample B. Schircks and M. Viscontini, University of Zurich, Zurich, Switzerland
Technique KBr WAFER

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FTIR Spectrum
Copyright Copyright © 2018-2024 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2018-2024 John Wiley & Sons, Inc. All Rights Reserved.
Source of Sample Aldrich
Source of Spectrum Sigma-Aldrich Co. LLC.
Catalog Number 360260
Technique Mull

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ATR-IR Spectrum
Copyright Copyright © 2019-2024 John Wiley & Sons, Inc. All Rights Reserved.
Source of Sample Cayman Chemical Company
Source of Spectrum Forensic Spectral Research
Catalog Number 12057

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1H NMR Spectrum
Copyright Copyright © 2009-2024 John Wiley & Sons, Inc. All Rights Reserved.
Solvent D2O/NaOD

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1H NMR Spectrum
Copyright Copyright © 2021-2024 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2021 John Wiley & Sons, Inc. All Rights Reserved.
Source of Sample Sigma-Aldrich Co. LLC.
Source of Spectrum Sigma-Aldrich Co. LLC.
Catalog Number 360260
Solvent DMSO-d6

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Raman Spectrum
Copyright Copyright © 2015-2024 John Wiley & Sons, Inc. All Rights Reserved.
Source of Sample Cayman Chemical Company
Source of Spectrum Forensic Spectral Research
Catalog Number 12057

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13C NMR Spectrum
Copyright Copyright © 2021-2024 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2021 John Wiley & Sons, Inc. All Rights Reserved.
Source of Sample Sigma-Aldrich Co. LLC.
Source of Spectrum Sigma-Aldrich Co. LLC.
Catalog Number 360260
Solvent DMSO-d6
  • 2-amino-6-(D-erythro-1,2,3-trihydroxypropyl)-4(3H)-pteridinone
  • NEOPTERIN, D-,
  • PTERIDINONE, 4/3H/-, 2-AMINO- 6-/D-ERYTHRO-1,2,3-TRIHYDROXYPROPYL/-,
  • D-(+)-Neopterin
  • D-erythro-Neopterin
2-amino-6-(L-erythro-1,2,3-trihydroxypropyl)-4-pteridinol
3-Aceto-5-[(1-ethoxycarbonyl-2,2,2-trifluoroethylamino)methyl]-4,5-dihydro-1H-pyrazole-5-carboxylicacid ethyl ester
5-(4-methoxyphenyl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine
5-(3-methoxyphenyl)-4-{[(E)-(2-nitrophenyl)methylidene]amino}-4H-1,2,4-triazole-3-thiol
7-(4-n-butylphenyl)-2,3,4,4a,5,6,10,10a-octahydroanthracene-2-one
N-Benzyl-2,4,5a,5b,5c,5D-hexahydro-cyclopropa(3,4)pentaleno(1,6-cd)piperidine
1,5-DIDEOXY-1,5-IMINO-3-O-(3-O-METHYL-ALPHA-ALPHA-D-GLUCOPYRANOSYL)-D-MANNITOL-HYDROCHLORIDE
5-(4-ethylphenyl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine
N-(5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)-2,2,3,3,4,4,4-heptafluorobutanamide
pyrazolo[1,5-a]pyrimidine, 5-[4-(1,1-dimethylethyl)phenyl]-7-(trifluoromethyl)-
1-[(2S,4S,5S)-4-azido-5-(hydroxymethyl)-2-oxolanyl]-2-(methylthio)-4-pyrimidinone

This compound is available in the following databases:

KnowItAll NMR Spectral Library
Author: Wiley

The KnowItAll NMR Spectral Library offers a comprehensive collection of NMR reference spectra, including NMR, CNMR, and XNMR, and covers a wide range of compounds including organics, polymers, monomers, metabolites, and more. Learn more.

KnowItAll IR, Raman, and UV-Vis Spectral Libraries
Author: Wiley

The KnowItAll IR, Raman, and UV-Vis spectral libraries offer access to the world's largest collection of IR, Raman, and UV-Vis spectra, including the renowned Sadtler spectra. The libraries include a wide range of compounds from pure organics to industrial compounds. Learn more.

Vendor/Supplier Catalog Number
Cayman Chemical Company
Other Resources
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