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

*Links on SpectraBase are not permalinks.
4-(benzo[b]thiophen-2-ylmethyl)phenyl pivalate
SpectraBase Compound ID Bnx3aY63Rsz
InChI InChI=1S/C20H20O2S/c1-20(2,3)19(21)22-16-10-8-14(9-11-16)12-17-13-15-6-4-5-7-18(15)23-17/h4-11,13H,12H2,1-3H3
InChIKey WYQAWFCCZPRQMJ-UHFFFAOYSA-N
Mol Weight 324.44 g/mol
Molecular Formula C20H20O2S
Exact Mass 324.118401 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 6gDUAOTl4Tg
Name 4-(benzo[b]thiophen-2-ylmethyl)phenyl pivalate
Alternate Name(s) 2,2-Dimethylpropanoic acid [4-(1-benzothiophen-2-ylmethyl)phenyl] ester [4-(benzothiophen-2-ylmethyl)phenyl] 2,2-dimethylpropanoate [4-(1-benzothiophen-2-ylmethyl)phenyl] 2,2-dimethylpropanoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H20O2S
InChI InChI=1S/C20H20O2S/c1-20(2,3)19(21)22-16-10-8-14(9-11-16)12-17-13-15-6-4-5-7-18(15)23-17/h4-11,13H,12H2,1-3H3
InChIKey WYQAWFCCZPRQMJ-UHFFFAOYSA-N
Molecular Weight 324.438 g/mol
SMILES c1ccc2sc(cc2c1)Cc1ccc(cc1)OC(=O)C(C)(C)C
SPLASH splash10-00du-0189000000-59970c862a98853aa38b
Source of Spectrum A1-14-1951/SM12-10e
Wiley ID 1750204