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Cyclohept[cd]isobenzofuran-3-carboxylic acid, 2,6,7,8,9,9a-hexahydro-9a-methoxy-2-oxo-, methyl ester
SpectraBase Compound ID KJ2C33o86oV
InChI InChI=1S/C15H16O5/c1-18-13(16)10-7-6-9-5-3-4-8-15(19-2)12(9)11(10)14(17)20-15/h6-7H,3-5,8H2,1-2H3
InChIKey BVEQUJKYCIKBPP-UHFFFAOYSA-N
Mol Weight 276.29 g/mol
Molecular Formula C15H16O5
Exact Mass 276.099774 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID A3NRzEMesDe
Name Cyclohept[cd]isobenzofuran-3-carboxylic acid, 2,6,7,8,9,9a-hexahydro-9a-methoxy-2-oxo-, methyl ester
Alternate Name(s) Methyl 9a-methoxy-2-oxo-2,6,7,8,9,9a-hexahydrocyclohepta[cd][2]benzofuran-3-carboxylate Methyl ester of 2a-methoxy-1-oxo-1,2a,3,4,5,6-hexahydrocyclohepta[cd]isobenzofuran-9-carboxylic acid
CAS Registry Number 74249-86-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H16O5
InChI InChI=1S/C15H16O5/c1-18-13(16)10-7-6-9-5-3-4-8-15(19-2)12(9)11(10)14(17)20-15/h6-7H,3-5,8H2,1-2H3
InChIKey BVEQUJKYCIKBPP-UHFFFAOYSA-N
Molecular Weight 276.288 g/mol
SMILES C12(OC(=O)c3c2c(ccc3C(=O)OC)CCCC1)OC
SPLASH splash10-014i-0190000000-588da04861e3bd8ad9b3
Source of Spectrum K-113-1590-0
Wiley ID 1279985