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6-Benzoyl-5-(3,4-dimethoxyphenyl)-1,5-dihydrotetrazolo[1,5-a]pyrimidine-7-carboxylic acid methyl ester
SpectraBase Compound ID CvBLafOQADj
InChI InChI=1S/C21H19N5O5/c1-29-14-10-9-13(11-15(14)30-2)17-16(19(27)12-7-5-4-6-8-12)18(20(28)31-3)26-21(22-17)23-24-25-26/h4-11,17H,1-3H3,(H,22,23,25)
InChIKey YKOUOUURKCEEMA-UHFFFAOYSA-N
Mol Weight 421.41 g/mol
Molecular Formula C21H19N5O5
Exact Mass 421.138619 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B0SFVqEDqfA
Name 6-Benzoyl-5-(3,4-dimethoxyphenyl)-1,5-dihydrotetrazolo[1,5-a]pyrimidine-7-carboxylic acid methyl ester
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H19N5O5
InChI InChI=1S/C21H19N5O5/c1-29-14-10-9-13(11-15(14)30-2)17-16(19(27)12-7-5-4-6-8-12)18(20(28)31-3)26-21(22-17)23-24-25-26/h4-11,17H,1-3H3,(H,22,23,25)
InChIKey YKOUOUURKCEEMA-UHFFFAOYSA-N
Molecular Weight 421.413 g/mol
SMILES N1c2[n](C(=C(C1c1cc(c(OC)cc1)OC)C(=O)c1ccccc1)C(=O)OC)nnn2
SPLASH splash10-0a6r-4933000000-6cb5764a7da0ca67af07
Synonyms Methyl 5-(3,4-dimethoxyphenyl)-6-(phenylcarbonyl)-1,5-dihydro-[1,2,3,4]tetrazolo[1,5-a]pyrimidine-7-carboxylate Methyl 6-benzoyl-5-(3,4-dimethoxyphenyl)-1,5-dihydrotetrazolo[1,5-a]pyrimidine-7-carboxylate
Wiley ID 1443144