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(1S,2R,5R,7S)-5-[(S)-1'-Hydroxyethyl)]-10,10-dimethyl-4-oxa-6-thiatricyclo[7.1.1.0(2,7)]undecane
SpectraBase Compound ID C23dLOKxoIR
InChI InChI=1S/C13H22O2S/c1-7(14)12-15-6-9-10-4-8(13(10,2)3)5-11(9)16-12/h7-12,14H,4-6H2,1-3H3/t7?,8-,9+,10+,11+,12+/m0/s1
InChIKey VGGUHBJTDJKZEK-LLTOIKLCSA-N
Mol Weight 242.38 g/mol
Molecular Formula C13H22O2S
Exact Mass 242.134051 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BJwyBOQwNWq
Name (1S,2R,5R,7S)-5-[(S)-1'-Hydroxyethyl)]-10,10-dimethyl-4-oxa-6-thiatricyclo[7.1.1.0(2,7)]undecane
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H22O2S
InChI InChI=1S/C13H22O2S/c1-7(14)12-15-6-9-10-4-8(13(10,2)3)5-11(9)16-12/h7-12,14H,4-6H2,1-3H3/t7?,8-,9+,10+,11+,12+/m0/s1
InChIKey VGGUHBJTDJKZEK-LLTOIKLCSA-N
Molecular Weight 242.377 g/mol
SMILES OC([C@@]1(OC[C@@]2([C@@]3(C(C)(C)[C@@](C3)(C[C@]2(S1)[H])[H])[H])[H])[H])C
SPLASH splash10-0005-5900000000-5b9c9a6b11a0850bca58
Source of Spectrum QC-12-3102-11
Wiley ID 1634796