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

*Links on SpectraBase are not permalinks.
Benzenebutanol, .beta.-methylene-, 4-methylbenzenesulfonate
SpectraBase Compound ID FJWU7SoAVjy
InChI InChI=1S/C18H20O3S/c1-15-9-12-18(13-10-15)22(19,20)21-14-16(2)8-11-17-6-4-3-5-7-17/h3-7,9-10,12-13H,2,8,11,14H2,1H3
InChIKey ZWLQMVCTCKEAGF-UHFFFAOYSA-N
Mol Weight 316.42 g/mol
Molecular Formula C18H20O3S
Exact Mass 316.113316 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 GbHtHvHOzbc
Name Benzenebutanol, .beta.-methylene-, 4-methylbenzenesulfonate
CAS Registry Number 75074-60-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H20O3S
InChI InChI=1S/C18H20O3S/c1-15-9-12-18(13-10-15)22(19,20)21-14-16(2)8-11-17-6-4-3-5-7-17/h3-7,9-10,12-13H,2,8,11,14H2,1H3
InChIKey ZWLQMVCTCKEAGF-UHFFFAOYSA-N
Molecular Weight 316.415 g/mol
SMILES c1(S(OCC(=C)CCc2ccccc2)(=O)=O)ccc(cc1)C
SPLASH splash10-0006-2900000000-27229a75f5dec36f3a29
Source of Spectrum I-58-1273-0
Synonyms 2-(2-phenylethyl)-2-propenyl 4-methylbenzenesulfonate 4-Phenyl-2-tosyloxymethyl-1-butene
Wiley ID 1316753