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cis-6-(phenylsulfonyl)-2,3,4,5,3a,7a-hexahydroindene
SpectraBase Compound ID 4wqSdWfOHg0
InChI InChI=1S/C15H18O2S/c16-18(17,14-7-2-1-3-8-14)15-10-9-12-5-4-6-13(12)11-15/h1-3,7-8,11-13H,4-6,9-10H2/t12-,13+/m0/s1
InChIKey QZMKPFBQPBVNRX-QWHCGFSZSA-N
Mol Weight 262.37 g/mol
Molecular Formula C15H18O2S
Exact Mass 262.102751 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EdaznOfGC7I
Name cis-6-(phenylsulfonyl)-2,3,4,5,3a,7a-hexahydroindene
CAS Registry Number 124243-73-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H18O2S
InChI InChI=1S/C15H18O2S/c16-18(17,14-7-2-1-3-8-14)15-10-9-12-5-4-6-13(12)11-15/h1-3,7-8,11-13H,4-6,9-10H2/t12-,13+/m0/s1
InChIKey QZMKPFBQPBVNRX-QWHCGFSZSA-N
Molecular Weight 262.367 g/mol
SMILES C1(S(=O)(=O)c2ccccc2)=C[C@]2(CCC[C@]2(CC1)[H])[H]
SPLASH splash10-0229-0960000000-837b8ec6f10f45a6ba6c
Source of Spectrum J-55-1273-7
Synonyms (3aS,7aS)-2,3,3a,6,7,7a-hexahydro-1H-inden-5-yl phenyl sulfone (3aS,7aS)-6-(phenylsulfonyl)-2,3,3a,4,5,7a-hexahydro-1H-indene
Wiley ID 1265783