For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
N-[3-({2-[(1-methyl-1H-tetraazol-5-yl)sulfanyl]acetyl}amino)phenyl]-1-adamantanecarboxamide
SpectraBase Compound ID AaBhPb9s6oY
InChI InChI=1S/C21H26N6O2S/c1-27-20(24-25-26-27)30-12-18(28)22-16-3-2-4-17(8-16)23-19(29)21-9-13-5-14(10-21)7-15(6-13)11-21/h2-4,8,13-15H,5-7,9-12H2,1H3,(H,22,28)(H,23,29)/t13-,14+,15-,21-
InChIKey KYOHUERLXPIHPQ-FZUGUKJMSA-N
Mol Weight 426.54 g/mol
Molecular Formula C21H26N6O2S
Exact Mass 426.183795 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 1sGsv2u1oJ6
Name N-[3-({2-[(1-methyl-1H-tetraazol-5-yl)sulfanyl]acetyl}amino)phenyl]-1-adamantanecarboxamide
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/C21H26N6O2S/c1-27-20(24-25-26-27)30-12-18(28)22-16-3-2-4-17(8-16)23-19(29)21-9-13-5-14(10-21)7-15(6-13)11-21/h2-4,8,13-15H,5-7,9-12H2,1H3,(H,22,28)(H,23,29)/t13-,14+,15-,21-
InChIKey KYOHUERLXPIHPQ-FZUGUKJMSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_31895
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: 1843496; SBI_ID: SBI-031899
Temperature 318 °C