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KTLJHLYMKCBOJM-UHFFFAOYSA-N
SpectraBase Compound ID 3jJT7eP8r2F
InChI InChI=1S/C12H16O3/c1-3-14-12(13)10-5-4-8(2)9-6-7-15-11(9)10/h6-8,10H,3-5H2,1-2H3
InChIKey KTLJHLYMKCBOJM-UHFFFAOYSA-N
Mol Weight 208.26 g/mol
Molecular Formula C12H16O3
Exact Mass 208.109944 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IW7uaifHmQL
Name 4-methyl-4,5,6,7-tetrahydrobenzofuran-7-carboxylic acid ethyl ester
Comments Less than 3 mono-isotopic peaks
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Formula C12H16O3
InChI InChI=1S/C12H16O3/c1-3-14-12(13)10-5-4-8(2)9-6-7-15-11(9)10/h6-8,10H,3-5H2,1-2H3
InChIKey KTLJHLYMKCBOJM-UHFFFAOYSA-N
Molecular Weight 208.257 g/mol
SMILES c12C(C(=O)OCC)CCC(c2cco1)C
SPLASH splash10-004i-0910000000-dd03aaaf2169a490cc73
Source of Spectrum H-2005-2088-5
Synonyms ethyl 4-methyl-4,5,6,7-tetrahydro-1-benzofuran-7-carboxylate ethyl 4-methyl-4,5,6,7-tetrahydrobenzofuran-7-carboxylate
Wiley ID 1562813