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(1R,4E,7R,9S)-9-benzoxy-5-(phenylthio)-10-oxabicyclo[5.2.1]dec-4-ene

View entire compound with spectra: 2 MS (GC)

(1R,4E,7R,9S)-9-benzoxy-5-(phenylthio)-10-oxabicyclo[5.2.1]dec-4-ene
SpectraBase Compound ID 5iIHgYLfTp9
InChI InChI=1S/C22H24O2S/c1-3-8-17(9-4-1)16-23-22-15-18-14-20(12-7-13-21(22)24-18)25-19-10-5-2-6-11-19/h1-6,8-12,18,21-22H,7,13-16H2/b20-12+/t18-,21+,22-/m0/s1
InChIKey GAZBIUOUMPHEGZ-NBPQHTMESA-N
Mol Weight 352.49 g/mol
Molecular Formula C22H24O2S
Exact Mass 352.149701 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Cna5kP5a11O
Name (1R,4E,7R,9S)-9-benzoxy-5-(phenylthio)-10-oxabicyclo[5.2.1]dec-4-ene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H24O2S
InChI InChI=1S/C22H24O2S/c1-3-8-17(9-4-1)16-23-22-15-18-14-20(12-7-13-21(22)24-18)25-19-10-5-2-6-11-19/h1-6,8-12,18,21-22H,7,13-16H2/b20-12+/t18-,21+,22-/m0/s1
InChIKey GAZBIUOUMPHEGZ-NBPQHTMESA-N
Molecular Weight 352.492 g/mol
SMILES [C@]12(C\C(=C/CC[C@]([C@](C2)(OCc2ccccc2)[H])(O1)[H])Sc1ccccc1)[H]
SPLASH splash10-0f6x-7920000000-446e2108875e0e3dca42
Source of Spectrum J-68-830-41
Synonyms (1R,4E,7R,9S)-9-benzyloxy-5-phenylsulfanyl-10-oxabicyclo[5.2.1]dec-4-ene (1R,4E,7R,9S)-9-phenylmethoxy-5-(phenylthio)-10-oxabicyclo[5.2.1]dec-4-ene (1R,4E,7R,9S)-9-phenylmethoxy-5-phenylsulfanyl-10-oxabicyclo[5.2.1]dec-4-ene
Wiley ID 1536272