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

*Links on SpectraBase are not permalinks.

4-Oxo-3-(phenylthio)pentanal

View entire compound with spectra: 1 MS (GC)

4-Oxo-3-(phenylthio)pentanal
SpectraBase Compound ID Hd587fXPAlk
InChI InChI=1S/C11H12O2S/c1-9(13)11(7-8-12)14-10-5-3-2-4-6-10/h2-6,8,11H,7H2,1H3
InChIKey RBGQXXLYOOQWGL-UHFFFAOYSA-N
Mol Weight 208.27 g/mol
Molecular Formula C11H12O2S
Exact Mass 208.055801 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 H4xLeaAQp3p
Name 4-Oxo-3-(phenylthio)pentanal
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H12O2S
InChI InChI=1S/C11H12O2S/c1-9(13)11(7-8-12)14-10-5-3-2-4-6-10/h2-6,8,11H,7H2,1H3
InChIKey RBGQXXLYOOQWGL-UHFFFAOYSA-N
Molecular Weight 208.275 g/mol
SMILES C(Sc1ccccc1)(C(=O)C)CC=O
SPLASH splash10-000i-0940000000-86db3934155fb7c121e1
Source of Spectrum J-60-8388-1
Synonyms 4-keto-3-(phenylthio)valeraldehyde 4-oxidanylidene-3-phenylsulfanyl-pentanal 4-oxo-3-phenylsulfanylpentanal
Wiley ID 1206496