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3-Carboxamido-8-methoxy-1,2,3-triazolo[1,5-a]-(1,3,5)-benzotriazepine-5-cyclopentylamine
SpectraBase Compound ID EmLs6hYytlb
InChI InChI=1S/C16H19N7O2/c1-25-10-6-7-12-11(8-10)19-16(18-9-4-2-3-5-9)20-15-13(14(17)24)21-22-23(12)15/h6-9H,2-5H2,1H3,(H2,17,24)(H2,18,19,20)
InChIKey PMTKKCLFMSDPJE-UHFFFAOYSA-N
Mol Weight 341.38 g/mol
Molecular Formula C16H19N7O2
Exact Mass 341.160023 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 95V4AjenVye
Name 3-Carboxamido-8-methoxy-1,2,3-triazolo[1,5-a]-(1,3,5)-benzotriazepine-5-cyclopentylamine
Comments Less than 3 mono-isotopic peaks
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Formula C16H19N7O2
InChI InChI=1S/C16H19N7O2/c1-25-10-6-7-12-11(8-10)19-16(18-9-4-2-3-5-9)20-15-13(14(17)24)21-22-23(12)15/h6-9H,2-5H2,1H3,(H2,17,24)(H2,18,19,20)
InChIKey PMTKKCLFMSDPJE-UHFFFAOYSA-N
Molecular Weight 341.375 g/mol
SMILES NC(c1nn[n]-2c1N=C(Nc1c2ccc(c1)OC)NC1CCCC1)=O
SPLASH splash10-0006-9002000000-a41ca8c85afd37221a5e
Source of Spectrum Y-39-1295-8
Wiley ID 1528697