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Spiro[tricyclo[3.3.1.1(3,7)]decane-2,6'-[1,2,4]trioxane],3'-methyl-5'-(methylthio)-, cis-
SpectraBase Compound ID 69A5BXsiALN
InChI InChI=1S/C14H22O3S/c1-8-15-13(18-2)14(17-16-8)11-4-9-3-10(6-11)7-12(14)5-9/h8-13H,3-7H2,1-2H3/t8?,9-,10+,11-,12+,13?,14-
InChIKey NZJPCGKDTHIVSA-SNUXBPRFSA-N
Mol Weight 270.39 g/mol
Molecular Formula C14H22O3S
Exact Mass 270.128966 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4fMVGtilfE1
Name Spiro[tricyclo[3.3.1.1(3,7)]decane-2,6'-[1,2,4]trioxane],3'-methyl-5'-(methylthio)-, cis-
CAS Registry Number 100330-60-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H22O3S
InChI InChI=1S/C14H22O3S/c1-8-15-13(18-2)14(17-16-8)11-4-9-3-10(6-11)7-12(14)5-9/h8-13H,3-7H2,1-2H3/t8?,9-,10+,11-,12+,13?,14-
InChIKey NZJPCGKDTHIVSA-SNUXBPRFSA-N
Molecular Weight 270.387 g/mol
SMILES C12(C(OC(OO2)C)SC)[C@]2(C[C@]3(C[C@@]1(C[C@@](C3)([H])C2)[H])[H])[H]
SPLASH splash10-0udi-1900000000-390e42c39ba77f9decf9
Source of Spectrum F-41-2087-0
Synonyms 5'-methyl-3'-(methylsulfanyl)spiro[adamantane-2,2'-[1,4,6]trioxane] Mixture of cis- and trans-3-methyl-5-(methylthio)-1,2,4-trioxanespiro[adamantane]
Wiley ID 1274006