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Spectral Data   Additional Data   Download  
Molecule
20132905
Chemical name(s)benzotriazole-1-carbonitrile
Chemical formulaC7H4N4
Molecular weight144.133
Number of double bond equivalents (DBEs)8.0
Number of all rings, size of smallest set of smallest rings3, 2
Canonical name(s)
CAS-Number
Additional information
Links from Unichem: ZINC;EPA (Environmental Protection Agency) CompTox Dashboard;Mcule;SureChEMBL;FDA/USP Substance Registration System (SRS);Nikkaji;eMolecules;PubChem Compounds;PubChem ('Thomson Pharma' subset);ACToR;M... (truncated)
Molecule keywords
DOI
13C Spectrum
20156280 Rating: 10
Type13C
Measurement conditions
Temperature [K]Unreported
SolventUnreported
Field Strength [MHz]Unreported
Assignment MethodUnreported
Literature
Additional comments10510.MOL.D3
Additional information
Spectrum categoriesocmainz inhouse-2




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