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1,4b,5,6,10,10a-Hexahydro-4b.beta.,8,10a.beta.-trimethyl-2-methyl-thiophenanthrene
SpectraBase Compound ID u3mdzD7M03
InChI InChI=1S/C18H24S/c1-13-6-5-10-18(3)15(13)9-11-17(2)12-14(19-4)7-8-16(17)18/h6-9H,5,10-12H2,1-4H3/t17-,18-/m1/s1
InChIKey RFGSVCCBCOUAOL-QZTJIDSGSA-N
Mol Weight 272.45 g/mol
Molecular Formula C18H24S
Exact Mass 272.159872 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6kRwxTaL1jz
Name 1,4b,5,6,10,10a-Hexahydro-4b.beta.,8,10a.beta.-trimethyl-2-methyl-thiophenanthrene
Alternate Name(s) (4bS,10aR)-4b,8,10a-trimethyl-1,4b,5,6,10,10a-hexahydro-2-phenanthrenyl methyl sulfide (4bS,10aR)-4b,8,10a-trimethyl-2-(methylsulfanyl)-1,4b,5,6,10,10a-hexahydrophenanthrene
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H24S
InChI InChI=1S/C18H24S/c1-13-6-5-10-18(3)15(13)9-11-17(2)12-14(19-4)7-8-16(17)18/h6-9H,5,10-12H2,1-4H3/t17-,18-/m1/s1
InChIKey RFGSVCCBCOUAOL-QZTJIDSGSA-N
Molecular Weight 272.450 g/mol
SMILES C1=2[C@]3(C(C(C)=CCC3)=CC[C@@]1(CC(=CC2)SC)C)C
SPLASH splash10-05fr-0090000000-044e475783ffdb55920b
Source of Spectrum AJ-61-3595-20
Wiley ID 1276629