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1-((3s,5s,7s)-adamantan-1-yl)-5-amino-1H-1,2,4-triazole-3-carboxylic acid hydrochloride

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1-((3s,5s,7s)-adamantan-1-yl)-5-amino-1H-1,2,4-triazole-3-carboxylic acid hydrochloride
SpectraBase Compound ID F3jYl52gDXP
InChI InChI=1S/C13H18N4O2.ClH/c14-12-15-10(11(18)19)16-17(12)13-4-7-1-8(5-13)3-9(2-7)6-13;/h7-9H,1-6H2,(H,18,19)(H2,14,15,16);1H/t7-,8+,9-,13-;
InChIKey SPFSJBJODPYFCD-SCLZJIHQSA-N
Mol Weight 298.77 g/mol
Molecular Formula C13H19ClN4O2
Exact Mass 298.119654 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID Iy44onH2NDp
Name 1-((3s,5s,7s)-adamantan-1-yl)-5-amino-1H-1,2,4-triazole-3-carboxylic acid hydrochloride
Author A.V.Yarkov, IPAC, Russia
Copyright Copyright © 2016-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2021 John Wiley & Sons, Inc. All Rights Reserved.
InChI InChI=1S/C13H18N4O2.ClH/c14-12-15-10(11(18)19)16-17(12)13-4-7-1-8(5-13)3-9(2-7)6-13;/h7-9H,1-6H2,(H,18,19)(H2,14,15,16);1H/t7-,8+,9-,13-;
InChIKey SPFSJBJODPYFCD-SCLZJIHQSA-N
NMR Offset 15.3537
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_1377
Owner Copyright (C) 2016 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright (C) 2016 John Wiley & Sons, Inc.
Sample State soluted
Solvent DMSO-d6
Source File Reference VendorID: 9311701; UBI_ID: UBI-001378
Temperature 308 °C