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Benzene, [[6-azido-1-ethenyl-3-(methoxymethoxy)-1-hexenyl]thio]-, (Z)-(.+-.)-
SpectraBase Compound ID 1XPp5fXa7Tu
InChI InChI=1S/C16H21N3O2S/c1-3-15(22-16-9-5-4-6-10-16)12-14(21-13-20-2)8-7-11-18-19-17/h3-6,9-10,12,14H,1,7-8,11,13H2,2H3/b15-12-
InChIKey ZSKDWFAUQPMMMW-QINSGFPZSA-N
Mol Weight 319.42 g/mol
Molecular Formula C16H21N3O2S
Exact Mass 319.135448 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AGEngm2EAEu
Name Benzene, [[6-azido-1-ethenyl-3-(methoxymethoxy)-1-hexenyl]thio]-, (Z)-(.+-.)-
CAS Registry Number 128845-36-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H21N3O2S
InChI InChI=1S/C16H21N3O2S/c1-3-15(22-16-9-5-4-6-10-16)12-14(21-13-20-2)8-7-11-18-19-17/h3-6,9-10,12,14H,1,7-8,11,13H2,2H3/b15-12-
InChIKey ZSKDWFAUQPMMMW-QINSGFPZSA-N
Molecular Weight 319.423 g/mol
SMILES C(N=[N+]=[N-])CCC(\C=C\(Sc1ccccc1)C=C)OCOC
SPLASH splash10-053r-0090000000-75ac7f7bdcfc665660d3
Source of Spectrum J-55-5733-53
Synonyms (Z)-8-Azido-5-(methoxymethoxy)-3-(phenylthio)-1,3-octadiene {[(1Z)-6-azido-3-(methoxymethoxy)-1-vinyl-1-hexenyl]sulfanyl}benzene
Wiley ID 1319293