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1-cyclohepta-1,3,5-trienecarboxylic acid ethyl ester
SpectraBase Compound ID 6jepzKzQ4yM
InChI InChI=1S/C10H12O2/c1-2-12-10(11)9-7-5-3-4-6-8-9/h3-7H,2,8H2,1H3
InChIKey JHNJOJBFADEHLK-UHFFFAOYSA-N
Mol Weight 164.2 g/mol
Molecular Formula C10H12O2
Exact Mass 164.08373 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HysqguQDjHT
Name 1-cyclohepta-1,3,5-trienecarboxylic acid ethyl ester
CAS Registry Number 27332-40-7
Comments Less than 3 mono-isotopic peaks
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Formula C10H12O2
InChI InChI=1S/C10H12O2/c1-2-12-10(11)9-7-5-3-4-6-8-9/h3-7H,2,8H2,1H3
InChIKey JHNJOJBFADEHLK-UHFFFAOYSA-N
Molecular Weight 164.204 g/mol
SMILES C(C1=CC=CC=CC1)(=O)OCC
SPLASH splash10-0006-9100000000-9820f4097ecfac4705f8
Source of Spectrum AJ-66-278-12
Synonyms Ethyl 1,3,5-Cycloheptatriene-1-carboxylate cyclohepta-1,3,5-triene-1-carboxylic acid ethyl ester ethyl cyclohepta-1,3,5-triene-1-carboxylate
Wiley ID 771946