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1H-Naphtho[1,8a-c]furan-8(3H)-one, octahydro-7-methyl-10-(phenylthio)-, (3a.alpha.,6a.alpha.,7.alpha.,10.beta.,10aR*)-(.+-.)-
SpectraBase Compound ID 8qAJw9A1FGd
InChI InChI=1S/C19H24O2S/c1-13-16-9-5-6-14-11-21-12-19(14,16)18(10-17(13)20)22-15-7-3-2-4-8-15/h2-4,7-8,13-14,16,18H,5-6,9-12H2,1H3/t13-,14+,16-,18+,19?/m1/s1
InChIKey RNDJQUBRCYMJSF-GJFZXWEGSA-N
Mol Weight 316.46 g/mol
Molecular Formula C19H24O2S
Exact Mass 316.149701 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 66j6FLgvlpX
Name 1H-Naphtho[1,8a-c]furan-8(3H)-one, octahydro-7-methyl-10-(phenylthio)-, (3a.alpha.,6a.alpha.,7.alpha.,10.beta.,10aR*)-(.+-.)-
CAS Registry Number 125409-74-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H24O2S
InChI InChI=1S/C19H24O2S/c1-13-16-9-5-6-14-11-21-12-19(14,16)18(10-17(13)20)22-15-7-3-2-4-8-15/h2-4,7-8,13-14,16,18H,5-6,9-12H2,1H3/t13-,14+,16-,18+,19?/m1/s1
InChIKey RNDJQUBRCYMJSF-GJFZXWEGSA-N
Molecular Weight 316.459 g/mol
SMILES C123[C@@]([C@@](C)(C(C[C@@]3(Sc3ccccc3)[H])=O)[H])(CCC[C@]2(COC1)[H])[H]
SPLASH splash10-066r-0179000000-efeb14bd4710c3e6023e
Source of Spectrum F-45-5605-16
Synonyms 3a.beta.,4,5,6,6a.beta.,7,9,10-octahydro-7.beta.-methyl-10.alpha.-phenylthio-1H-naphtho[1.8a.alpha.-c]furan-8(3H)-one (3aR,6aR,7R,10S)-7-methyl-10-(phenylsulfanyl)octahydronaphtho[1,8a-c]furan-8(3H)-one 3a.beta.,4,5,6,6a.beta.,7,9,10-octahydro-7.beta.-methyl-10.beta.-phenylthio-1H-naphtho[1.8a.alpha.-C]furan-8(3H)-one
Wiley ID 1316892