For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
Methyl-4-benzhydryl-2-benzyl-3,5-dioxohexanoate
SpectraBase Compound ID 9pwBYNzgxVD
InChI InChI=1S/C27H26O4/c1-19(28)24(25(21-14-8-4-9-15-21)22-16-10-5-11-17-22)26(29)23(27(30)31-2)18-20-12-6-3-7-13-20/h3-17,23-25H,18H2,1-2H3
InChIKey YOZBTAVJLXIQCV-UHFFFAOYSA-N
Mol Weight 414.5 g/mol
Molecular Formula C27H26O4
Exact Mass 414.183109 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID HW17q4A4QGi
Name Methyl-4-benzhydryl-2-benzyl-3,5-dioxohexanoate
CAS Registry Number 129006-60-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C27H26O4
InChI InChI=1S/C27H26O4/c1-19(28)24(25(21-14-8-4-9-15-21)22-16-10-5-11-17-22)26(29)23(27(30)31-2)18-20-12-6-3-7-13-20/h3-17,23-25H,18H2,1-2H3
InChIKey YOZBTAVJLXIQCV-UHFFFAOYSA-N
Molecular Weight 414.501 g/mol
SMILES C(C(C(=O)OC)Cc1ccccc1)(C(C(c1ccccc1)c1ccccc1)C(=O)C)=O
SPLASH splash10-066r-2950000000-39348ee9df9b677e31b4
Source of Spectrum F-46-2043-9
Wiley ID 1375644