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METHYL-2,4-DIPHENYL-3-BENZOXEPINE-1-CARBOXYLATE
SpectraBase Compound ID A86u6gDWFcn
InChI InChI=1S/C24H18O3/c1-26-24(25)22-20-15-9-8-14-19(20)16-21(17-10-4-2-5-11-17)27-23(22)18-12-6-3-7-13-18/h2-16H,1H3
InChIKey UJRAOEYTZBMOOA-UHFFFAOYSA-N
Mol Weight 354.41 g/mol
Molecular Formula C24H18O3
Exact Mass 354.125594 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6ze8kO4WQCL
Name 3-Benzoxepin-1-carboxylic acid, 2,4-diphenyl-, methyl ester
Alternate Name(s) Methyl 2,4-diphenyl-3-benzoxepin-1-carboxylate Methyl 2,4-diphenyl-3-benzoxepine-1-carboxylate
CAS Registry Number 64362-24-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H18O3
InChI InChI=1S/C24H18O3/c1-26-24(25)22-20-15-9-8-14-19(20)16-21(17-10-4-2-5-11-17)27-23(22)18-12-6-3-7-13-18/h2-16H,1H3
InChIKey UJRAOEYTZBMOOA-UHFFFAOYSA-N
Molecular Weight 354.405 g/mol
SMILES C1(=C(OC(c2ccccc2)=Cc2c1cccc2)c1ccccc1)C(=O)OC
SPLASH splash10-0a4i-2900000000-39ca2e6d640bd55c8a00
Source of Spectrum I-55-1430-0
Wiley ID 1344993