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

*Links on SpectraBase are not permalinks.
3-(1-adamantyl)-1-phenyl-1H-pyrazole-4-carboxylic acid
SpectraBase Compound ID BqTvGhbrEPT
InChI InChI=1S/C20H22N2O2/c23-19(24)17-12-22(16-4-2-1-3-5-16)21-18(17)20-9-13-6-14(10-20)8-15(7-13)11-20/h1-5,12-15H,6-11H2,(H,23,24)/t13-,14+,15-,20-
InChIKey HJDASZASOCACNB-PVGDPBLGSA-N
Mol Weight 322.41 g/mol
Molecular Formula C20H22N2O2
Exact Mass 322.168128 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

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

SpectraBase Spectrum ID TxPcH5NG03
Name Pyrazole-4-carboxylic acid, 3-(1-adamantyl)-1-phenyl-
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H22N2O2
InChI InChI=1S/C20H22N2O2/c23-19(24)17-12-22(16-4-2-1-3-5-16)21-18(17)20-9-13-6-14(10-20)8-15(7-13)11-20/h1-5,12-15H,6-11H2,(H,23,24)/t13-,14+,15-,20-
InChIKey HJDASZASOCACNB-PVGDPBLGSA-N
Molecular Weight 322.408 g/mol
SMILES OC(c1c(n[n](c1)-c1ccccc1)C12C[C@]3(C[C@@](C2)(C[C@@](C1)(C3)[H])[H])[H])=O
SPLASH splash10-00di-6569000000-b0b6f2c130a721ac9b56
Source of Spectrum AD-0-2532-0
Synonyms 3-(1-Adamantyl)-1-phenyl-1H-pyrazole-4-carboxylic acid 3-(1-adamantyl)-1-phenyl-4-pyrazolecarboxylic acid 3-(1-adamantyl)-1-phenyl-pyrazole-4-carboxylic acid
Wiley ID 1433909