SpectraBase Spectrum ID |
A1lB0drB1Tw |
Name |
2,5-Cyclohexadiene-1-carboxylic acid, 2-methyl-4-(1H-pyrrol-2-yl)-, cis- |
CAS Registry Number |
73794-65-7 |
Copyright |
Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C12H13NO2 |
InChI |
InChI=1S/C12H13NO2/c1-8-7-9(11-3-2-6-13-11)4-5-10(8)12(14)15/h2-7,9-10,13H,1H3,(H,14,15)/t9-,10+/m0/s1 |
InChIKey |
ROKIGFAOHCHRHX-VHSXEESVSA-N |
Molecular Weight |
203.241 g/mol |
SMILES |
[nH]1cccc1[C@]1(C=C[C@@](C(=O)O)(C(=C1)C)[H])[H] |
SPLASH |
splash10-0a4l-5910000000-e221711780f31eaddc68 |
Source of Spectrum |
K-114-3152-0 |
Wiley ID |
1200829 |