Debug Info

object
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_id
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Fn5xty12d9U
spectrumID
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Fn5xty12d9U
cost
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1
specType
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262144
xnmrNucleus
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NOX:149252:1
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analyticalTechnique
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13C NMR
analyticalTechniqueLongName
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13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
isFullSpectrum
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compound
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1735074081058
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Skatole
SpectraBase Compound ID EEBKHVEub9F
InChI InChI=1S/C9H9N/c1-7-6-10-9-5-3-2-4-8(7)9/h2-6,10H,1H3
InChIKey ZFRKQXVRDFCRJG-UHFFFAOYSA-N
Mol Weight 131.18 g/mol
Molecular Formula C9H9N
Exact Mass 131.073499 g/mol
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13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Fn5xty12d9U
Name 1H-Indole, 3-methyl-
CAS Registry Number 83-34-1
Comments FROM JOHNSON, REASSIGNED
Copyright Copyright © 2002-2025 Wiley-VCH GmbH. All Rights Reserved.
Formula C9H9N
InChI InChI=1S/C9H9N/c1-7-6-10-9-5-3-2-4-8(7)9/h2-6,10H,1H3
InChIKey ZFRKQXVRDFCRJG-UHFFFAOYSA-N
Instrument Name Varian XL-100
Literature Reference M.S. Morales-Rios, P. Joseph-Nathan, Magn. Res. Chem. 25, 377 (1987).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3
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