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

*Links on SpectraBase are not permalinks.
(3aR,6aR)-2,2-dimethyl-3a-(phenylsulfanylmethyl)-6aH-cyclopenta[d][1,3]dioxol-4-one
SpectraBase Compound ID 8oLKy7l3hxf
InChI InChI=1S/C15H16O3S/c1-14(2)17-13-9-8-12(16)15(13,18-14)10-19-11-6-4-3-5-7-11/h3-9,13H,10H2,1-2H3/t13-,15+/m1/s1
InChIKey YPNOLYPNRRWQMF-HIFRSBDPSA-N
Mol Weight 276.35 g/mol
Molecular Formula C15H16O3S
Exact Mass 276.082016 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 96koEasTwz4
Name (3aR,6aR)-2,2-dimethyl-3a-(phenylsulfanylmethyl)-6aH-cyclopenta[d][1,3]dioxol-4-one
CAS Registry Number 129076-52-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H16O3S
InChI InChI=1S/C15H16O3S/c1-14(2)17-13-9-8-12(16)15(13,18-14)10-19-11-6-4-3-5-7-11/h3-9,13H,10H2,1-2H3/t13-,15+/m1/s1
InChIKey YPNOLYPNRRWQMF-HIFRSBDPSA-N
Molecular Weight 276.350 g/mol
SMILES [C@@]12(OC(C)(C)O[C@@]2(C=CC1=O)[H])CSc1ccccc1
SPLASH splash10-0002-9110000000-f1fc6b32db6595fe02f8
Source of Spectrum F-46-2604-16
Synonyms (3aR,6aR)-2,2-dimethyl-3a-[(phenylthio)methyl]-6aH-cyclopenta[d][1,3]dioxol-4-one
Wiley ID 1279959