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4-Cyclopentene-1,2,3-tricarboxylic acid, 4,5-diphenyl-, trimethyl ester, (1.alpha.,2.alpha.,3.beta.)-
SpectraBase Compound ID 2qPUV3lvLrJ
InChI InChI=1S/C23H22O6/c1-27-21(24)18-16(14-10-6-4-7-11-14)17(15-12-8-5-9-13-15)19(22(25)28-2)20(18)23(26)29-3/h4-13,18-20H,1-3H3/t18-,19-/m0/s1
InChIKey UKWOCHXWEVHGBX-OALUTQOASA-N
Mol Weight 394.42 g/mol
Molecular Formula C23H22O6
Exact Mass 394.141638 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ENqXlzKKekJ
Name 4-Cyclopentene-1,2,3-tricarboxylic acid, 4,5-diphenyl-, trimethyl ester, (1.alpha.,2.alpha.,3.beta.)-
CAS Registry Number 67472-76-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H22O6
InChI InChI=1S/C23H22O6/c1-27-21(24)18-16(14-10-6-4-7-11-14)17(15-12-8-5-9-13-15)19(22(25)28-2)20(18)23(26)29-3/h4-13,18-20H,1-3H3/t18-,19-/m0/s1
InChIKey UKWOCHXWEVHGBX-OALUTQOASA-N
Molecular Weight 394.423 g/mol
SMILES C1(=C([C@](C(=O)OC)(C([C@]1(C(=O)OC)[H])C(=O)OC)[H])c1ccccc1)c1ccccc1
SPLASH splash10-0159-0079000000-002cd4413469390a5a23
Source of Spectrum C-100-4171-0
Synonyms Methyl 2,5-bis(methoxy carbonyl)-3,4-diphenyl-3-cyclopentenoic acid Trimethyl (1R,3R)-4,5-diphenyl-4-cyclopentene-1,2,3-tricarboxylate
Wiley ID 1366694