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(dl)-3-(3',4',5'-Trimethoxyphenyl)-3,4-dihydroisocoumarin

View entire compound with spectra: 2 MS (GC)

(dl)-3-(3',4',5'-Trimethoxyphenyl)-3,4-dihydroisocoumarin
SpectraBase Compound ID 5L2rNF03R6w
InChI InChI=1S/C18H18O5/c1-20-15-9-12(10-16(21-2)17(15)22-3)14-8-11-6-4-5-7-13(11)18(19)23-14/h4-7,9-10,14H,8H2,1-3H3
InChIKey POEWIVNKGLEUGB-UHFFFAOYSA-N
Mol Weight 314.34 g/mol
Molecular Formula C18H18O5
Exact Mass 314.115424 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID J95E4Kx8hWJ
Name (dl)-3-(3',4',5'-Trimethoxyphenyl)-3,4-dihydroisocoumarin
Alternate Name(s) 3-(3,4,5-trimethoxyphenyl)-3,4-dihydro-1H-2-benzopyran-1-one 3-(3,4,5-trimethoxyphenyl)isochroman-1-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H18O5
InChI InChI=1S/C18H18O5/c1-20-15-9-12(10-16(21-2)17(15)22-3)14-8-11-6-4-5-7-13(11)18(19)23-14/h4-7,9-10,14H,8H2,1-3H3
InChIKey POEWIVNKGLEUGB-UHFFFAOYSA-N
Molecular Weight 314.337 g/mol
SMILES c1ccc2c(c1)CC(c1cc(c(c(c1)OC)OC)OC)OC2=O
SPLASH splash10-014i-3903000000-82bafab4dca86b1aafab
Source of Spectrum Y1-42B-4-12c
Wiley ID 1744205