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6-Benzoyl-5-(3-nitro-phenyl)-4,5-dihydro-tetrazolo[1,5-a]pyrimidine-7-carboxylic acid methyl ester
SpectraBase Compound ID IZYpZCyJHe7
InChI InChI=1S/C19H14N6O5/c1-30-18(27)16-14(17(26)11-6-3-2-4-7-11)15(20-19-21-22-23-24(16)19)12-8-5-9-13(10-12)25(28)29/h2-10,15H,1H3,(H,20,21,23)
InChIKey QKSKDFWPQCHRPX-UHFFFAOYSA-N
Mol Weight 406.36 g/mol
Molecular Formula C19H14N6O5
Exact Mass 406.102568 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID e0pOo97sya
Name 6-Benzoyl-5-(3-nitro-phenyl)-4,5-dihydro-tetrazolo[1,5-a]pyrimidine-7-carboxylic acid methyl ester
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H14N6O5
InChI InChI=1S/C19H14N6O5/c1-30-18(27)16-14(17(26)11-6-3-2-4-7-11)15(20-19-21-22-23-24(16)19)12-8-5-9-13(10-12)25(28)29/h2-10,15H,1H3,(H,20,21,23)
InChIKey QKSKDFWPQCHRPX-UHFFFAOYSA-N
Molecular Weight 406.358 g/mol
SMILES N1c2[n](C(=C(C1c1cc(N(=O)=O)ccc1)C(=O)c1ccccc1)C(=O)OC)nnn2
SPLASH splash10-0a4i-6910000000-fd119a2e079b406a0d9c
Synonyms Methyl 6-benzoyl-5-(3-nitrophenyl)-4,5-dihydrotetraazolo[1,5-a]pyrimidine-7-carboxylate
Wiley ID 1442895