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1,3-Heptadiene, 7-azido-3-(methylthio)-, (Z)-
SpectraBase Compound ID AHqPLz1bSka
InChI InChI=1S/C8H13N3S/c1-3-8(12-2)6-4-5-7-10-11-9/h3,6H,1,4-5,7H2,2H3/b8-6-
InChIKey ZVFIXLUEILBGNS-VURMDHGXSA-N
Mol Weight 183.27 g/mol
Molecular Formula C8H13N3S
Exact Mass 183.083019 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BI9qldrYPVi
Name 1,3-Heptadiene, 7-azido-3-(methylthio)-, (Z)-
CAS Registry Number 128845-11-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H13N3S
InChI InChI=1S/C8H13N3S/c1-3-8(12-2)6-4-5-7-10-11-9/h3,6H,1,4-5,7H2,2H3/b8-6-
InChIKey ZVFIXLUEILBGNS-VURMDHGXSA-N
Molecular Weight 183.273 g/mol
SMILES C(N=[N+]=[N-])CC\C=C\(C=C)SC
SPLASH splash10-00di-9200000000-e751d56622633800f879
Source of Spectrum J-55-5734-22
Synonyms (1Z)-5-azido-1-vinyl-1-pentenyl methyl sulfide (3Z)-7-azido-3-(methylsulfanyl)-1,3-heptadiene (Z)-7-Azido-3-(methylthio)hepta-1,3-diene
Wiley ID 1179586