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4(S)-Methyl-2-[(2,4,6-triisopyopylphenyl)sulfinyl]-2-cyclopentenone
SpectraBase Compound ID AOmWuP9SbHT
InChI InChI=1S/C21H30O2S/c1-12(2)16-10-17(13(3)4)21(18(11-16)14(5)6)24(23)20-9-15(7)8-19(20)22/h9-15H,8H2,1-7H3/t15-,24?/m0/s1
InChIKey QSARPNDMXLIVDE-FZADBTJQSA-N
Mol Weight 346.53 g/mol
Molecular Formula C21H30O2S
Exact Mass 346.196651 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1T15hZqMhwG
Name 4(S)-Methyl-2-[(2,4,6-triisopyopylphenyl)sulfinyl]-2-cyclopentenone
Alternate Name(s) (4S)-4-methyl-2-[(2,4,6-triisopropylphenyl)sulfinyl]-2-cyclopenten-1-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H30O2S
InChI InChI=1S/C21H30O2S/c1-12(2)16-10-17(13(3)4)21(18(11-16)14(5)6)24(23)20-9-15(7)8-19(20)22/h9-15H,8H2,1-7H3/t15-,24?/m0/s1
InChIKey QSARPNDMXLIVDE-FZADBTJQSA-N
Molecular Weight 346.529 g/mol
SMILES C=1(S(c2c(cc(cc2C(C)C)C(C)C)C(C)C)=O)C(C[C@@](C1)(C)[H])=O
SPLASH splash10-000i-0981000000-fcf7bb2f9c6f6c94d139
Source of Spectrum J-63-3903-4
Wiley ID 1339445