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3-[(3-keto-5,5-dimethyl-cyclohexen-1-yl)disulfanyl]-5,5-dimethyl-cyclohex-2-en-1-one
SpectraBase Compound ID EtMCxH4zRb4
InChI InChI=1S/C16H22O2S2/c1-15(2)7-11(17)5-13(9-15)19-20-14-6-12(18)8-16(3,4)10-14/h5-6H,7-10H2,1-4H3
InChIKey DPMRRKUTDFYZSF-UHFFFAOYSA-N
Mol Weight 310.47 g/mol
Molecular Formula C16H22O2S2
Exact Mass 310.106122 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4YNahpuwNP
Name 3-[(3-keto-5,5-dimethyl-cyclohexen-1-yl)disulfanyl]-5,5-dimethyl-cyclohex-2-en-1-one
Alternate Name(s) 3-[(5,5-dimethyl-3-oxidanylidene-cyclohexen-1-yl)disulfanyl]-5,5-dimethyl-cyclohex-2-en-1-one 3-[(5,5-dimethyl-3-oxo-1-cyclohexenyl)disulfanyl]-5,5-dimethyl-1-cyclohex-2-enone 3-[(5,5-dimethyl-3-oxo-cyclohexen-1-yl)disulfanyl]-5,5-dimethyl-cyclohex-2-en-1-one
CAS Registry Number 51759-21-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H22O2S2
InChI InChI=1S/C16H22O2S2/c1-15(2)7-11(17)5-13(9-15)19-20-14-6-12(18)8-16(3,4)10-14/h5-6H,7-10H2,1-4H3
InChIKey DPMRRKUTDFYZSF-UHFFFAOYSA-N
Molecular Weight 310.470 g/mol
SMILES C1=C(SSC2=CC(=O)CC(C2)(C)C)CC(CC1=O)(C)C
SPLASH splash10-0ufr-4290000000-4894f7ef5f46644f352d
Source of Spectrum SB-28-1087-13
Wiley ID 1311374