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2-Phenylthiomethyl-3-dimethoxymethyl-cyclopentan-1-one
SpectraBase Compound ID DGpNVWBbuJo
InChI InChI=1S/C15H20O3S/c1-17-15(18-2)12-8-9-14(16)13(12)10-19-11-6-4-3-5-7-11/h3-7,12-13,15H,8-10H2,1-2H3
InChIKey XTAJZWDAYCRYEZ-UHFFFAOYSA-N
Mol Weight 280.38 g/mol
Molecular Formula C15H20O3S
Exact Mass 280.113316 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1XvzpfqnuGT
Name 2-Phenylthiomethyl-3-dimethoxymethyl-cyclopentan-1-one
Alternate Name(s) 2-Phenylthiomethyl-3-dimethoxymethyl-cyclopentanone 3-(dimethoxymethyl)-2-[(phenylsulfanyl)methyl]cyclopentanone
CAS Registry Number 127477-61-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H20O3S
InChI InChI=1S/C15H20O3S/c1-17-15(18-2)12-8-9-14(16)13(12)10-19-11-6-4-3-5-7-11/h3-7,12-13,15H,8-10H2,1-2H3
InChIKey XTAJZWDAYCRYEZ-UHFFFAOYSA-N
Molecular Weight 280.382 g/mol
SMILES C1(C(CCC1=O)C(OC)OC)CSc1ccccc1
SPLASH splash10-0uki-4890000000-963df599b89ea8783dcb
Source of Spectrum F-45-7028-7
Wiley ID 1283763