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1-(3-Phenylpropylsulfanyl)propan-2-one

View entire compound with spectra: 1 MS (GC)

1-(3-Phenylpropylsulfanyl)propan-2-one
SpectraBase Compound ID 7f25hNZkcDa
InChI InChI=1S/C12H16OS/c1-11(13)10-14-9-5-8-12-6-3-2-4-7-12/h2-4,6-7H,5,8-10H2,1H3
InChIKey AXDZLNGVAKXOCR-UHFFFAOYSA-N
Mol Weight 208.32 g/mol
Molecular Formula C12H16OS
Exact Mass 208.092186 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID F5bukzZBicE
Name 1-(3-Phenylpropylsulfanyl)propan-2-one
Alternate Name(s) 1-[(3-Phenylpropyl)sulfanyl]acetone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H16OS
InChI InChI=1S/C12H16OS/c1-11(13)10-14-9-5-8-12-6-3-2-4-7-12/h2-4,6-7H,5,8-10H2,1H3
InChIKey AXDZLNGVAKXOCR-UHFFFAOYSA-N
Molecular Weight 208.319 g/mol
SMILES C(C(C)=O)SCCCc1ccccc1
SPLASH splash10-066u-9860000000-9e43afcacf95175ba21f
Source of Spectrum KC-0-1925-44
Wiley ID 784195