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(3S,4E,6S)-6-[(2-methoxyethoxy)methoxy]-2-methyl-4-(methylthio)-4-hepten-3-ol
SpectraBase Compound ID DAQ1qgYWRD2
InChI InChI=1S/C13H26O4S/c1-10(2)13(14)12(18-5)8-11(3)17-9-16-7-6-15-4/h8,10-11,13-14H,6-7,9H2,1-5H3/b12-8+/t11-,13-/m0/s1
InChIKey GWMFIWZWNXDTLQ-OVJSSFAUSA-N
Mol Weight 278.41 g/mol
Molecular Formula C13H26O4S
Exact Mass 278.15518 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GM2Ji9QJiAW
Name (3S,4E,6S)-6-[(2-methoxyethoxy)methoxy]-2-methyl-4-(methylthio)-4-hepten-3-ol
CAS Registry Number 114091-77-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H26O4S
InChI InChI=1S/C13H26O4S/c1-10(2)13(14)12(18-5)8-11(3)17-9-16-7-6-15-4/h8,10-11,13-14H,6-7,9H2,1-5H3/b12-8+/t11-,13-/m0/s1
InChIKey GWMFIWZWNXDTLQ-OVJSSFAUSA-N
Molecular Weight 278.407 g/mol
SMILES O[C@](\C(=C/[C@@](OCOCCOC)(C)[H])SC)(C(C)C)[H]
SPLASH splash10-022i-0950000000-933691fbb1acf659b4e3
Source of Spectrum K-124-1391-31
Synonyms (3S,4E,6S)-6-[(2-methoxyethoxy)methoxy]-2-methyl-4-(methylsulfanyl)-4-hepten-3-ol
Wiley ID 1281682