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Bicyclo[2.2.1]heptan-2-ol, 7,7-dimethyl-1-[[(2-phenylethenyl)sulfinyl]methyl]-, [1S-[1.alpha.[S*(Z)],2.beta.,4.beta.]]-
SpectraBase Compound ID B07CgXahpze
InChI InChI=1S/C18H24O2S/c1-17(2)15-8-10-18(17,16(19)12-15)13-21(20)11-9-14-6-4-3-5-7-14/h3-7,9,11,15-16,19H,8,10,12-13H2,1-2H3/b11-9-/t15-,16-,18-,21?/m1/s1
InChIKey VGZWWEZVCIUUMU-CSPPUNFQSA-N
Mol Weight 304.45 g/mol
Molecular Formula C18H24O2S
Exact Mass 304.149701 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2sbY7rvDaOv
Name Bicyclo[2.2.1]heptan-2-ol, 7,7-dimethyl-1-[[(2-phenylethenyl)sulfinyl]methyl]-, [1S-[1.alpha.[S*(Z)],2.beta.,4.beta.]]-
CAS Registry Number 127994-60-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H24O2S
InChI InChI=1S/C18H24O2S/c1-17(2)15-8-10-18(17,16(19)12-15)13-21(20)11-9-14-6-4-3-5-7-14/h3-7,9,11,15-16,19H,8,10,12-13H2,1-2H3/b11-9-/t15-,16-,18-,21?/m1/s1
InChIKey VGZWWEZVCIUUMU-CSPPUNFQSA-N
Molecular Weight 304.448 g/mol
SMILES O[C@]1([C@]2(C([C@]([H])(CC2)C1)(C)C)CS(\C=C/c1ccccc1)=O)[H]
SPLASH splash10-0079-0493000000-15764bb3880c41d2774d
Source of Spectrum F-45-7020-3
Synonyms (1S,2R,4R)-7,7-dimethyl-1-({[(Z)-2-phenylethenyl]sulfinyl}methyl)bicyclo[2.2.1]heptan-2-ol (Z)-(1S,2R,4R,5R)-7,7-dimethyl-1-(2'-phenylethenylsulfinyl)methyl-bicyclo[2.2.1]heptan-2-ol
Wiley ID 1306542