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(1R,3R,6S,9R)-3-(1-(2-Naphthyl)ethyl]-11,11-dimethyl-2-oxa-4-thiatricyclo[4.4.0.1(6,9)]undecane
SpectraBase Compound ID 9jfrje2MEKL
InChI InChI=1S/C23H28O2S/c1-21(2)17-10-11-23(21)14-26-20(25-19(23)13-17)22(3,24)18-9-8-15-6-4-5-7-16(15)12-18/h4-9,12,17,19-20,24H,10-11,13-14H2,1-3H3/t17-,19-,20-,22?,23-/m0/s1
InChIKey VTJKYLOKWKJZEU-VUVGJRHDSA-N
Mol Weight 368.54 g/mol
Molecular Formula C23H28O2S
Exact Mass 368.181001 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1faK99KxkT6
Name (1R,3R,6S,9R)-3-(1-(2-Naphthyl)ethyl]-11,11-dimethyl-2-oxa-4-thiatricyclo[4.4.0.1(6,9)]undecane
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H28O2S
InChI InChI=1S/C23H28O2S/c1-21(2)17-10-11-23(21)14-26-20(25-19(23)13-17)22(3,24)18-9-8-15-6-4-5-7-16(15)12-18/h4-9,12,17,19-20,24H,10-11,13-14H2,1-3H3/t17-,19-,20-,22?,23-/m0/s1
InChIKey VTJKYLOKWKJZEU-VUVGJRHDSA-N
Molecular Weight 368.535 g/mol
SMILES OC([C@@]1(SC[C@]23[C@@](O1)(C[C@@](C3(C)C)(CC2)[H])[H])[H])(c1cc2ccccc2cc1)C
SPLASH splash10-002g-5900000000-bb3650510ee3bd9088fd
Source of Spectrum H1-44-402-19
Synonyms (1R,3R,6S,9R)-3-(1-(2-Naphthyl)ethyl]-11,11-dimethyl-2-oxa-4-thiatricyclo[4.4.0.1(6,9)]undecane diasterisomer 1-(11,11-dimethyl-5-oxa-3-thiatricyclo[6.2.1.0(1,6)]undec-4-yl)-1-(2-naphthyl)ethanol
Wiley ID 758239