SpectraBase Spectrum ID |
FgcAmdKL1rg |
Name |
[Bi-2,4,6-cycloheptatrien-1-yl]-3,3'-dicarboxylic acid, (R*,S*)- |
CAS Registry Number |
89548-92-5 |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C16H14O4 |
InChI |
InChI=1S/C16H14O4/c17-15(18)13-7-3-1-5-11(9-13)12-6-2-4-8-14(10-12)16(19)20/h1-12H,(H,17,18)(H,19,20)/t11-,12+ |
InChIKey |
IDDQGBDKKPOEEI-TXEJJXNPSA-N |
Molecular Weight |
270.284 g/mol |
SMILES |
OC(C1=C[C@]([C@@]2(C=C(C(=O)O)C=CC=C2)[H])(C=CC=C1)[H])=O |
SPLASH |
splash10-004i-0940000000-553b5082d691e5e4e2fe |
Source of Spectrum |
K-117-821-0 |
Synonyms |
(3R)-3-[(1S)-3-carboxycyclohepta-2,4,6-trien-1-yl]cyclohepta-1,4,6-triene-1-carboxylic acid
meso-bi-2,4,6-cycloheptatriene-1-yl]-3,3'-dicarboxylic acid |
Wiley ID |
1274338 |