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

*Links on SpectraBase are not permalinks.
1-Benzoyl-2-(4-methylthiophenoxy)-5-pentyl formate
SpectraBase Compound ID 5Hbdv5yKjz6
InChI InChI=1S/C20H22O3S/c1-16-9-11-18(12-10-16)24-19(8-5-13-23-15-21)14-20(22)17-6-3-2-4-7-17/h2-4,6-7,9-12,15,19H,5,8,13-14H2,1H3
InChIKey CXMKXFGXXJQISF-UHFFFAOYSA-N
Mol Weight 342.45 g/mol
Molecular Formula C20H22O3S
Exact Mass 342.128966 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 DLzjVMFmmti
Name 1-Benzoyl-2-(4-methylthiophenoxy)-5-pentyl formate
Alternate Name(s) 4-[(4-methylphenyl)sulfanyl]-6-oxo-6-phenylhexyl formate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H22O3S
InChI InChI=1S/C20H22O3S/c1-16-9-11-18(12-10-16)24-19(8-5-13-23-15-21)14-20(22)17-6-3-2-4-7-17/h2-4,6-7,9-12,15,19H,5,8,13-14H2,1H3
InChIKey CXMKXFGXXJQISF-UHFFFAOYSA-N
Molecular Weight 342.453 g/mol
SMILES C(CC(Sc1ccc(cc1)C)CCCOC=O)(=O)c1ccccc1
SPLASH splash10-0a6u-9800000000-dcec9d36357869d506fc
Source of Spectrum F-53-6606-146
Wiley ID 802094