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2,7-Dithiabicyclo[2.2.1]heptan-3-one, 1-(ethylthio)-6,6-dimethyl-5-(2-methyl-1-propenylidene)-4-phenyl-
SpectraBase Compound ID DosABMt5L8H
InChI InChI=1S/C19H22OS3/c1-6-21-19-17(4,5)15(12-13(2)3)18(23-19,16(20)22-19)14-10-8-7-9-11-14/h7-11H,6H2,1-5H3
InChIKey JIERXBUAQHCEJO-UHFFFAOYSA-N
Mol Weight 362.56 g/mol
Molecular Formula C19H22OS3
Exact Mass 362.083279 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 21HwvAFcXPw
Name 2,7-Dithiabicyclo[2.2.1]heptan-3-one, 1-(ethylthio)-6,6-dimethyl-5-(2-methyl-1-propenylidene)-4-phenyl-
CAS Registry Number 100107-59-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H22OS3
InChI InChI=1S/C19H22OS3/c1-6-21-19-17(4,5)15(12-13(2)3)18(23-19,16(20)22-19)14-10-8-7-9-11-14/h7-11H,6H2,1-5H3
InChIKey JIERXBUAQHCEJO-UHFFFAOYSA-N
Molecular Weight 362.564 g/mol
SMILES C12(SC(=O)C(S2)(c2ccccc2)C(C1(C)C)=C=C(C)C)SCC
SPLASH splash10-0umu-0494000000-6efbc0ab17c52fe2f70c
Source of Spectrum K-118-3455-5
Synonyms 1-(ethylsulfanyl)-6,6-dimethyl-5-(2-methyl-1-propenylidene)-4-phenyl-2,7-dithiabicyclo[2.2.1]heptan-3-one 1-Ethylthio-6,6-dimethyl-5-(2-methyl-1-propenyliden-2,7-dithiabicyclo[2.2.1]-heptao-3-on
Wiley ID 1349480