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1-Propene, 1-[(2-methylpropyl-2-D)sulfinyl]-
SpectraBase Compound ID BGNxha2GRKr
InChI InChI=1S/C7H14OS/c1-4-5-9(8)6-7(2)3/h4-5,7H,6H2,1-3H3/b5-4+/i7D
InChIKey VKMJPJMSRVKOHZ-PYNZSEKMSA-N
Mol Weight 147.25 g/mol
Molecular Formula C7H13DOS
Exact Mass 147.082813 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID I96s8bShXyE
Name 1-Propene, 1-[(2-methylpropyl-2-D)sulfinyl]-
Alternate Name(s) [2-(Deuterio)-S-isobutyl]-2-propenyl-sulfoxide
CAS Registry Number 124469-86-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H13DOS
InChI InChI=1S/C7H14OS/c1-4-5-9(8)6-7(2)3/h4-5,7H,6H2,1-3H3/b5-4+/i7D
InChIKey VKMJPJMSRVKOHZ-PYNZSEKMSA-N
Molecular Weight 147.254 g/mol
SMILES C\C=C\S(=O)CC(C)(C)[D]
SPLASH splash10-0006-9000000000-ecc8596941856a7e8b22
Source of Spectrum O-24-340-7
Wiley ID 1143981