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2,5-Pyridinedicarboxylic acid, 4-[3,4-dimethoxy-2-(phenylmethoxy)phenyl]-3,6-dimethyl-, 2-methyl ester, 1-oxide
SpectraBase Compound ID 7RxapA4GufE
InChI InChI=1S/C25H25NO8/c1-14-19(20(24(27)28)15(2)26(30)21(14)25(29)33-5)17-11-12-18(31-3)23(32-4)22(17)34-13-16-9-7-6-8-10-16/h6-12H,13H2,1-5H3,(H,27,28)
InChIKey BZZVVNBHMXPVLS-UHFFFAOYSA-N
Mol Weight 467.47 g/mol
Molecular Formula C25H25NO8
Exact Mass 467.158017 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AmBrMocKkFr
Name 2,5-Pyridinedicarboxylic acid, 4-[3,4-dimethoxy-2-(phenylmethoxy)phenyl]-3,6-dimethyl-, 2-methyl ester, 1-oxide
CAS Registry Number 74615-03-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H25NO8
InChI InChI=1S/C25H25NO8/c1-14-19(20(24(27)28)15(2)26(30)21(14)25(29)33-5)17-11-12-18(31-3)23(32-4)22(17)34-13-16-9-7-6-8-10-16/h6-12H,13H2,1-5H3,(H,27,28)
InChIKey BZZVVNBHMXPVLS-UHFFFAOYSA-N
Molecular Weight 467.474 g/mol
SMILES OC(c1c([n+](c(c(C)c1-c1c(c(OC)c(cc1)OC)OCc1ccccc1)C(=O)OC)[O-])C)=O
SPLASH splash10-0ldi-0032900000-da7dc2f4462e97c410e2
Source of Spectrum C-104-542-0
Synonyms 2-Methyl hydrogen 4-(3,4-dimethoxy-2-(phenylmethoxy)phenyl)-3,6-dimethyl-2,5-pyridinedicarboxylate 1-oxide 4-[2-(benzyloxy)-3,4-dimethoxyphenyl]-6-(methoxycarbonyl)-2,5-dimethylnicotinic acid 1-oxide
Wiley ID 1392172