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[1,1'-Biphenyl]-2-carboxylic acid, 3',4,4',5,5',6-hexamethoxy-2'-(2-oxopropyl)-, ethyl ester
SpectraBase Compound ID E8VHpUum0kd
InChI InChI=1S/C24H30O9/c1-9-33-24(26)16-12-18(28-4)22(31-7)23(32-8)19(16)14-11-17(27-3)21(30-6)20(29-5)15(14)10-13(2)25/h11-12H,9-10H2,1-8H3
InChIKey XVFOZSSLJZOVAQ-UHFFFAOYSA-N
Mol Weight 462.5 g/mol
Molecular Formula C24H30O9
Exact Mass 462.188983 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3sTJI5TRDtT
Name [1,1'-Biphenyl]-2-carboxylic acid, 3',4,4',5,5',6-hexamethoxy-2'-(2-oxopropyl)-, ethyl ester
Alternate Name(s) Ethyl 2'-acetonyl-3',4,4',5,5',6-hexamethoxybiphenyl-2-carboxylate Ethyl 3',4,4',5,5',6-hexamethoxy-2'-(2-oxopropyl)[1,1'-biphenyl]-2-carboxylate
CAS Registry Number 80141-01-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H30O9
InChI InChI=1S/C24H30O9/c1-9-33-24(26)16-12-18(28-4)22(31-7)23(32-8)19(16)14-11-17(27-3)21(30-6)20(29-5)15(14)10-13(2)25/h11-12H,9-10H2,1-8H3
InChIKey XVFOZSSLJZOVAQ-UHFFFAOYSA-N
Molecular Weight 462.495 g/mol
SMILES c1(-c2c(c(OC)c(c(c2)OC)OC)CC(=O)C)c(cc(c(c1OC)OC)OC)C(=O)OCC
SPLASH splash10-01ot-0009400000-bf5e914b8fc798791d25
Source of Spectrum B-34-811-0
Wiley ID 1391006