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1H,3H-3a,7a-(Methanothiomethano)isobenzofuran, 4,7-dihydro-5,6-dimethyl-
SpectraBase Compound ID nMqcF9g33b
InChI InChI=1S/C12H18OS/c1-9-3-11-5-13-6-12(11,4-10(9)2)8-14-7-11/h3-8H2,1-2H3/t11-,12+
InChIKey AXZVLBWHUCDTEB-TXEJJXNPSA-N
Mol Weight 210.33 g/mol
Molecular Formula C12H18OS
Exact Mass 210.107836 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Ev0KCufDiQ6
Name 1H,3H-3a,7a-(Methanothiomethano)isobenzofuran, 4,7-dihydro-5,6-dimethyl-
CAS Registry Number 58634-43-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H18OS
InChI InChI=1S/C12H18OS/c1-9-3-11-5-13-6-12(11,4-10(9)2)8-14-7-11/h3-8H2,1-2H3/t11-,12+
InChIKey AXZVLBWHUCDTEB-TXEJJXNPSA-N
Molecular Weight 210.335 g/mol
SMILES [C@@]123[C@@](CC(=C(C3)C)C)(CSC1)COC2
SPLASH splash10-03di-2690000000-f19fa1d10c327b784c08
Source of Spectrum K-109-798-0
Synonyms 3,4-Dimethyl-8-oxa-11-thia(4,3,3)propell-3-ene 3,4-Dimethyl-8-oxa-11-thiatricyclo[4.3.3.0(1,6)]dodec-3-ene
Wiley ID 1209104