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2-Methyl-3-phenylthio-1-propanol acetate

View entire compound with spectra: 1 NMR, and 1 MS (GC)

2-Methyl-3-phenylthio-1-propanol acetate
SpectraBase Compound ID 4CfwsRyeVYg
InChI InChI=1S/C12H16O2S/c1-10(8-14-11(2)13)9-15-12-6-4-3-5-7-12/h3-7,10H,8-9H2,1-2H3
InChIKey YXRMWGSHQCXTDG-UHFFFAOYSA-N
Mol Weight 224.32 g/mol
Molecular Formula C12H16O2S
Exact Mass 224.087101 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LSmydzaJpt7
Name 2-Methyl-3-phenylthio-1-propanol acetate
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H16O2S
InChI InChI=1S/C12H16O2S/c1-10(8-14-11(2)13)9-15-12-6-4-3-5-7-12/h3-7,10H,8-9H2,1-2H3
InChIKey YXRMWGSHQCXTDG-UHFFFAOYSA-N
Molecular Weight 224.318 g/mol
SMILES C(=O)(OCC(CSc1ccccc1)C)C
SPLASH splash10-0006-9400000000-bda985cb084743efc0fe
Source of Spectrum AJ-69-2102-2
Synonyms 2-Methyl-3-(phenylsulfanyl)propyl acetate
Wiley ID 773862