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4,5-Dimethoxy-2'-methoxycarbonyl-5',6'-methylenedioxybiphenyl-2-carboxylic acid
SpectraBase Compound ID Hm5iKqx0fZx
InChI InChI=1S/C18H16O8/c1-22-13-6-10(11(17(19)20)7-14(13)23-2)15-9(18(21)24-3)4-5-12-16(15)26-8-25-12/h4-7H,8H2,1-3H3,(H,19,20)
InChIKey PKSKEANASODVHN-UHFFFAOYSA-N
Mol Weight 360.32 g/mol
Molecular Formula C18H16O8
Exact Mass 360.084517 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Kfj5hCqcBrg
Name 4,5-Dimethoxy-2'-methoxycarbonyl-5',6'-methylenedioxybiphenyl-2-carboxylic acid
Alternate Name(s) 4,5-Dimethoxy-2-[5-(methoxycarbonyl)-1,3-benzodioxol-4-yl]benzoic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H16O8
InChI InChI=1S/C18H16O8/c1-22-13-6-10(11(17(19)20)7-14(13)23-2)15-9(18(21)24-3)4-5-12-16(15)26-8-25-12/h4-7H,8H2,1-3H3,(H,19,20)
InChIKey PKSKEANASODVHN-UHFFFAOYSA-N
Molecular Weight 360.318 g/mol
SMILES OC(c1c(-c2c(C(=O)OC)ccc3c2OCO3)cc(c(OC)c1)OC)=O
SPLASH splash10-03di-0019000000-156f6229a5fcf460fbc8
Source of Spectrum KC-1993-1478-22
Wiley ID 778192