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Pentalene, octahydro-2-methylene-3a-(phenylsulfonyl)-, cis-
SpectraBase Compound ID LUIORJgIQef
InChI InChI=1S/C15H18O2S/c1-12-10-13-6-5-9-15(13,11-12)18(16,17)14-7-3-2-4-8-14/h2-4,7-8,13H,1,5-6,9-11H2/t13-,15-/m1/s1
InChIKey PHAUKCJCHYIWIE-UKRRQHHQSA-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 L2ugYy4o20l
Name Pentalene, octahydro-2-methylene-3a-(phenylsulfonyl)-, cis-
CAS Registry Number 72048-04-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H18O2S
InChI InChI=1S/C15H18O2S/c1-12-10-13-6-5-9-15(13,11-12)18(16,17)14-7-3-2-4-8-14/h2-4,7-8,13H,1,5-6,9-11H2/t13-,15-/m1/s1
InChIKey PHAUKCJCHYIWIE-UKRRQHHQSA-N
Molecular Weight 262.367 g/mol
SMILES [C@@]12(S(=O)(=O)c3ccccc3)[C@@](CC(C1)=C)(CCC2)[H]
SPLASH splash10-00dl-9700000000-e14a566e0ff5cef3ff7d
Source of Spectrum C-105-2325-0
Synonyms (3aR,6aR)-2-methylene-3a-(phenylsulfonyl)octahydropentalene (3aR,6aR)-2-methylenehexahydro-3a(1H)-pentalenyl phenyl sulfone cis-1-(phenylsulfonyl)-3-methylenebicyclo[3.3.0]octane
Wiley ID 1265774