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(8S/8R)-Methyl 8-methyl-2-oxo-2,5,6,7,8-pentahydro-2H-benzo[b]pyran-3-ylcarboxylate
SpectraBase Compound ID 87mipI8NyRF
InChI InChI=1S/C12H14O4/c1-7-4-3-5-8-6-9(11(13)15-2)12(14)16-10(7)8/h6-7H,3-5H2,1-2H3
InChIKey YYBFVDHXEZEDCH-UHFFFAOYSA-N
Mol Weight 222.24 g/mol
Molecular Formula C12H14O4
Exact Mass 222.089209 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JNtkEwHJWfc
Name (8S/8R)-Methyl 8-methyl-2-oxo-2,5,6,7,8-pentahydro-2H-benzo[b]pyran-3-ylcarboxylate
Alternate Name(s) Methyl 8-methyl-2-oxo-2,5,6,7,8-pentahydro-2H-benzo[b]pyran-3-ylcarboxylate Methyl 8-methyl-2-oxo-5,6,7,8-tetrahydro-2H-chromene-3-carboxylate 8-Methyl-2-oxo-5,6,7,8-tetrahydro-1-benzopyran-3-carboxylic acid methyl ester Methyl 8-methyl-2-oxo-5,6,7,8-tetrahydrochromene-3-carboxylate Methyl 8-methyl-2-oxidanylidene-5,6,7,8-tetrahydrochromene-3-carboxylate
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Formula C12H14O4
InChI InChI=1S/C12H14O4/c1-7-4-3-5-8-6-9(11(13)15-2)12(14)16-10(7)8/h6-7H,3-5H2,1-2H3
InChIKey YYBFVDHXEZEDCH-UHFFFAOYSA-N
Molecular Weight 222.240 g/mol
SMILES C=1(C(OC2=C(C1)CCCC2C)=O)C(=O)OC
SPLASH splash10-009i-0920000000-a256780562f1e4b4199d
Source of Spectrum C5-2003-2029-9
Wiley ID 1615878