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all-cis-12-methylthio-dodeca-1,3,6,9-tetraene

View entire compound with spectra: 1 MS (GC)

all-cis-12-methylthio-dodeca-1,3,6,9-tetraene
SpectraBase Compound ID 3LQn0yKKAdi
InChI InChI=1S/C13H20S/c1-3-4-5-6-7-8-9-10-11-12-13-14-2/h3-5,7-8,10-11H,1,6,9,12-13H2,2H3/b5-4-,8-7-,11-10-
InChIKey HRZYHBNRXLVXAJ-YSTUJMKBSA-N
Mol Weight 208.36 g/mol
Molecular Formula C13H20S
Exact Mass 208.128572 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID A5UmLq16UR7
Name all-cis-12-methylthio-dodeca-1,3,6,9-tetraene
Alternate Name(s) (3Z,6Z,9Z)-12-(methylsulfanyl)-1,3,6,9-dodecatetraene (3Z,6Z,9Z)-3,6,9,11-dodecatetraenyl methyl sulfide
CAS Registry Number 115465-56-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H20S
InChI InChI=1S/C13H20S/c1-3-4-5-6-7-8-9-10-11-12-13-14-2/h3-5,7-8,10-11H,1,6,9,12-13H2,2H3/b5-4-,8-7-,11-10-
InChIKey HRZYHBNRXLVXAJ-YSTUJMKBSA-N
Molecular Weight 208.363 g/mol
SMILES C(\C=C/C\C=C/C\C=C/CCSC)=C
SPLASH splash10-03di-9110000000-d00342705c12dfa082fb
Source of Spectrum K-121-2243-39
Wiley ID 1207348