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Methyl 3-tert-Butyl-1-methoxy-1H-isochromene-4-carboxylate
SpectraBase Compound ID IRrO3l3tMil
InChI InChI=1S/C16H20O4/c1-16(2,3)13-12(14(17)18-4)10-8-6-7-9-11(10)15(19-5)20-13/h6-9,15H,1-5H3
InChIKey PNRFKHSJARVYQP-UHFFFAOYSA-N
Mol Weight 276.33 g/mol
Molecular Formula C16H20O4
Exact Mass 276.136159 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IZjEA6gFGoR
Name Methyl 3-tert-Butyl-1-methoxy-1H-isochromene-4-carboxylate
Alternate Name(s) 3-tert-Butyl-1-methoxy-1H-2-benzopyran-4-carboxylic acid methyl ester
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Formula C16H20O4
InChI InChI=1S/C16H20O4/c1-16(2,3)13-12(14(17)18-4)10-8-6-7-9-11(10)15(19-5)20-13/h6-9,15H,1-5H3
InChIKey PNRFKHSJARVYQP-UHFFFAOYSA-N
Molecular Weight 276.332 g/mol
SMILES C1(=C(OC(c2c1cccc2)OC)C(C)(C)C)C(=O)OC
SPLASH splash10-014i-0390000000-0253c3c1682493f62c23
Source of Spectrum U1-2011-5633-4c
Wiley ID 1703179