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2(3H)-Furanone, 3-(1,3-benzodioxol-5-ylmethylene)-4-(3,4-dimethoxybenzoyl)dihydro-, (E)-
SpectraBase Compound ID GPF7WJGy0OQ
InChI InChI=1S/C21H18O7/c1-24-16-6-4-13(9-18(16)25-2)20(22)15-10-26-21(23)14(15)7-12-3-5-17-19(8-12)28-11-27-17/h3-9,15H,10-11H2,1-2H3/b14-7+
InChIKey DBAVTGWCNCGLKV-VGOFMYFVSA-N
Mol Weight 382.37 g/mol
Molecular Formula C21H18O7
Exact Mass 382.105253 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BB2sYnxneJr
Name 2(3H)-Furanone, 3-(1,3-benzodioxol-5-ylmethylene)-4-(3,4-dimethoxybenzoyl)dihydro-, (E)-
Alternate Name(s) (3E)-3-(1,3-benzodioxol-5-ylmethylene)-4-(3,4-dimethoxybenzoyl)dihydro-2(3H)-furanone (E)-3-(3'',4''-dimethoxybenzyl)-2-methyl-enedioxybenzylidene)butyrolactone
CAS Registry Number 118826-06-5
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H18O7
InChI InChI=1S/C21H18O7/c1-24-16-6-4-13(9-18(16)25-2)20(22)15-10-26-21(23)14(15)7-12-3-5-17-19(8-12)28-11-27-17/h3-9,15H,10-11H2,1-2H3/b14-7+
InChIKey DBAVTGWCNCGLKV-VGOFMYFVSA-N
Molecular Weight 382.368 g/mol
SMILES C1(\C(C(OC1)=O)=C/c1cc2OCOc2cc1)C(c1cc(OC)c(cc1)OC)=O
SPLASH splash10-014i-0900000000-16cc0bdca9c637f0e93b
Source of Spectrum KC-1988-1610-6
Wiley ID 1360538