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1,2-Cyclopropanediacetic acid, 1,2-diphenyl-, trans-
SpectraBase Compound ID HjgXNzFmoqK
InChI InChI=1S/C19H18O4/c20-16(21)11-18(14-7-3-1-4-8-14)13-19(18,12-17(22)23)15-9-5-2-6-10-15/h1-10H,11-13H2,(H,20,21)(H,22,23)/t18-,19-/m1/s1
InChIKey YNPSRESXGZRWLC-RTBURBONSA-N
Mol Weight 310.35 g/mol
Molecular Formula C19H18O4
Exact Mass 310.120509 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Itc5aoLo5dA
Name 1,2-Cyclopropanediacetic acid, 1,2-diphenyl-, trans-
Alternate Name(s) trans-1,2-diphenylcyclopropane-1,2-diacetic acid [(1S,2S)-2-(carboxymethyl)-1,2-diphenylcyclopropyl]acetic acid
CAS Registry Number 111977-20-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H18O4
InChI InChI=1S/C19H18O4/c20-16(21)11-18(14-7-3-1-4-8-14)13-19(18,12-17(22)23)15-9-5-2-6-10-15/h1-10H,11-13H2,(H,20,21)(H,22,23)/t18-,19-/m1/s1
InChIKey YNPSRESXGZRWLC-RTBURBONSA-N
Molecular Weight 310.349 g/mol
SMILES OC(C[C@]1([C@](CC(=O)O)(C1)c1ccccc1)c1ccccc1)=O
SPLASH splash10-052f-8690000000-12dbdc02602935ef36db
Source of Spectrum C-110-499-16
Wiley ID 1311717