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ETHYL-5-(1-CYCLOHEXEN-1-YL)-3,4-HEXADIENOATE
SpectraBase Compound ID 7lu5JSylaiW
InChI InChI=1S/C14H20O2/c1-3-16-14(15)11-7-8-12(2)13-9-5-4-6-10-13/h7,9H,3-6,10-11H2,1-2H3
InChIKey ACOYXTHTUJSYDO-UHFFFAOYSA-N
Mol Weight 220.31 g/mol
Molecular Formula C14H20O2
Exact Mass 220.14633 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CBH220knYOY
Name 5-(1-cyclohexenyl)hexa-3,4-dienoic acid ethyl ester
Alternate Name(s) 5-(cyclohexen-1-yl)hexa-3,4-dienoic acid ethyl ester ethyl 5-(cyclohexen-1-yl)hexa-3,4-dienoate
CAS Registry Number 127915-55-3
Comments Less than 3 mono-isotopic peaks
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Formula C14H20O2
InChI InChI=1S/C14H20O2/c1-3-16-14(15)11-7-8-12(2)13-9-5-4-6-10-13/h7,9H,3-6,10-11H2,1-2H3
InChIKey ACOYXTHTUJSYDO-UHFFFAOYSA-N
Molecular Weight 220.312 g/mol
SMILES C(=C=CCC(=O)OCC)(C1=CCCCC1)C
SPLASH splash10-0a4i-0930000000-cc59157769159d300dfb
Source of Spectrum K-123-2178-15
Wiley ID 1220244