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Carbamic acid, 1,5-heptadienyl-, methyl ester, (E,E)-
SpectraBase Compound ID J6UNbcW0Yjc
InChI InChI=1S/C9H15NO2/c1-3-4-5-6-7-8-10-9(11)12-2/h3-4,7-8H,5-6H2,1-2H3,(H,10,11)/b4-3+,8-7+
InChIKey QTJRQXAFWPFACF-DYWGDJMRSA-N
Mol Weight 169.22 g/mol
Molecular Formula C9H15NO2
Exact Mass 169.110279 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 71pYzUTBhpx
Name Carbamic acid, 1,5-heptadienyl-, methyl ester, (E,E)-
Alternate Name(s) (1E,5E)-1-[N-(methoxycarbonyl)amino]-1,5-heptadiene methyl (1E,5E)-1,5-heptadienylcarbamate
CAS Registry Number 99747-22-5
Comments Less than 3 mono-isotopic peaks
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Formula C9H15NO2
InChI InChI=1S/C9H15NO2/c1-3-4-5-6-7-8-10-9(11)12-2/h3-4,7-8H,5-6H2,1-2H3,(H,10,11)/b4-3+,8-7+
InChIKey QTJRQXAFWPFACF-DYWGDJMRSA-N
Molecular Weight 169.224 g/mol
SMILES N(C(=O)OC)\C=C\CC\C=C\C
SPLASH splash10-001i-9400000000-f9ccf176f0fd286211a4
Source of Spectrum J-51-172-22
Wiley ID 1165795