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

*Links on SpectraBase are not permalinks.

(1R)-1-[1(S)-1,2-Dihydroxyethyl]butyl (Phenylthio)acetate

View entire compound with spectra: 1 MS (GC)

(1R)-1-[1(S)-1,2-Dihydroxyethyl]butyl (Phenylthio)acetate
SpectraBase Compound ID AkefWKM9BpE
InChI InChI=1S/C14H20O4S/c1-2-6-13(12(16)9-15)18-14(17)10-19-11-7-4-3-5-8-11/h3-5,7-8,12-13,15-16H,2,6,9-10H2,1H3/t12-,13+/m0/s1
InChIKey ODRODXVDKRAROQ-QWHCGFSZSA-N
Mol Weight 284.37 g/mol
Molecular Formula C14H20O4S
Exact Mass 284.10823 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 6y7nkMkkKwH
Name (1R)-1-[1(S)-1,2-Dihydroxyethyl]butyl (Phenylthio)acetate
Alternate Name(s) (1R)-1-[(1S)-1,2-dihydroxyethyl]butyl (phenylsulfanyl)acetate 2-(Phenylthio)acetic acid[(1R)-1-[(1S)-1,2-dihydroxyethyl]butyl]ester 2-(Phenylthio)acetic acid[(2S,3R)-1,2-dihydroxyhexan-3-yl]ester [(1R)-1-[(1S)-1,2-dihydroxyethyl]butyl]2-phenylsulfanylacetate [(2S,3R)-1,2-bis(oxidanyl)hexan-3-yl]2-phenylsulfanylethanoate [(2S,3R)-1,2-dihydroxyhexan-3-yl]2-phenylsulfanylacetate 2-(Phenylthio)acetic acid [(2S,3R)-1,2-dihydroxyhexan-3-yl] ester [(2S,3R)-1,2-dihydroxyhexan-3-yl] 2-phenylsulfanylacetate [(1R)-1-[(1S)-1,2-dihydroxyethyl]butyl] 2-phenylsulfanylacetate [(2S,3R)-1,2-bis(oxidanyl)hexan-3-yl] 2-phenylsulfanylethanoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H20O4S
InChI InChI=1S/C14H20O4S/c1-2-6-13(12(16)9-15)18-14(17)10-19-11-7-4-3-5-8-11/h3-5,7-8,12-13,15-16H,2,6,9-10H2,1H3/t12-,13+/m0/s1
InChIKey ODRODXVDKRAROQ-QWHCGFSZSA-N
Molecular Weight 284.370 g/mol
SMILES O[C@@](CO)([C@](OC(=O)CSc1ccccc1)(CCC)[H])[H]
SPLASH splash10-00xr-0910000000-ff109c8bf1b5e715c57c
Source of Spectrum J-59-4467-3
Wiley ID 1287627