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4aH-Benzocyclohepten-4a-ol, decahydro-4-methylene-1-(phenylsulfonyl)-, (1.alpha.,4a.beta.,9a.beta.)-
SpectraBase Compound ID Er8AiyYtWYo
InChI InChI=1S/C18H24O3S/c1-14-11-12-17(16-10-6-3-7-13-18(14,16)19)22(20,21)15-8-4-2-5-9-15/h2,4-5,8-9,16-17,19H,1,3,6-7,10-13H2
InChIKey MGJVHTCYMIXHNP-UHFFFAOYSA-N
Mol Weight 320.45 g/mol
Molecular Formula C18H24O3S
Exact Mass 320.144616 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LjDWzSdaBRg
Name 4aH-Benzocyclohepten-4a-ol, decahydro-4-methylene-1-(phenylsulfonyl)-, (1.alpha.,4a.beta.,9a.beta.)-
CAS Registry Number 127257-55-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H24O3S
InChI InChI=1S/C18H24O3S/c1-14-11-12-17(16-10-6-3-7-13-18(14,16)19)22(20,21)15-8-4-2-5-9-15/h2,4-5,8-9,16-17,19H,1,3,6-7,10-13H2
InChIKey MGJVHTCYMIXHNP-UHFFFAOYSA-N
Molecular Weight 320.447 g/mol
SMILES OC12C(C(S(=O)(=O)c3ccccc3)CCC1=C)CCCCC2
SPLASH splash10-004i-0900000000-da90f8f64fb7e3b6b488
Source of Spectrum J-55-3965-23
Synonyms 1-Hydroxy-2-methylene-5-(phenylsulfonyl)bicyclo[4.5.0]undecane 4-Methylene-1-(phenylsulfonyl)decahydro-4aH-benzo[a]cyclohepten-4a-ol
Wiley ID 1320118