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2-(2-ketocycloheptyl)acrylic acid ethyl ester
SpectraBase Compound ID H61XE4qEGks
InChI InChI=1S/C12H18O3/c1-3-15-12(14)9(2)10-7-5-4-6-8-11(10)13/h10H,2-8H2,1H3
InChIKey VKABLCLGESHVON-UHFFFAOYSA-N
Mol Weight 210.27 g/mol
Molecular Formula C12H18O3
Exact Mass 210.125594 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7ZxCNAwfetE
Name 2-(2-ketocycloheptyl)acrylic acid ethyl ester
Alternate Name(s) 2-(2-oxocycloheptyl)-2-propenoic acid ethyl ester Ethyl 2-(2-oxidanylidenecycloheptyl)prop-2-enoate Ethyl 2-(2-oxocycloheptyl)prop-2-enoate
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Formula C12H18O3
InChI InChI=1S/C12H18O3/c1-3-15-12(14)9(2)10-7-5-4-6-8-11(10)13/h10H,2-8H2,1H3
InChIKey VKABLCLGESHVON-UHFFFAOYSA-N
Molecular Weight 210.273 g/mol
SMILES C(C(=C)C1C(CCCCC1)=O)(=O)OCC
SPLASH splash10-0ar3-7910000000-73435cdb37766064073b
Source of Spectrum AJ-74-1959-7
Wiley ID 1576884