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2-(1-Benzyl-1H-indol-3-yl)-4-oxo-4-phenylbutanoic acid
SpectraBase Compound ID HceXun8Wmt9
InChI InChI=1S/C25H21NO3/c27-24(19-11-5-2-6-12-19)15-21(25(28)29)22-17-26(16-18-9-3-1-4-10-18)23-14-8-7-13-20(22)23/h1-14,17,21H,15-16H2,(H,28,29)
InChIKey SCVVSPICUFOPGD-UHFFFAOYSA-N
Mol Weight 383.45 g/mol
Molecular Formula C25H21NO3
Exact Mass 383.152144 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HdhNzF3dNbE
Name 2-(1-Benzyl-1H-indol-3-yl)-4-oxo-4-phenylbutanoic acid
CAS Registry Number 312928-56-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H21NO3
InChI InChI=1S/C25H21NO3/c27-24(19-11-5-2-6-12-19)15-21(25(28)29)22-17-26(16-18-9-3-1-4-10-18)23-14-8-7-13-20(22)23/h1-14,17,21H,15-16H2,(H,28,29)
InChIKey SCVVSPICUFOPGD-UHFFFAOYSA-N
Molecular Weight 383.447 g/mol
SMILES OC(C(c1c[n](Cc2ccccc2)c2c1cccc2)CC(=O)c1ccccc1)=O
SPLASH splash10-052f-9210000000-e151d9b4177b393d337c
Synonyms 2-(1-benzylindol-3-yl)-4-keto-4-phenyl-butyric acid 2-(1-benzylindol-3-yl)-4-oxo-4-phenyl-butanoic acid 4-Oxidanylidene-4-phenyl-2-[1-(phenylmethyl)indol-3-yl]butanoic acid 4-Oxo-4-phenyl-2-[1-(phenylmethyl)-3-indolyl]butanoic acid
Wiley ID 1438111