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4-(1H-Benzotriazol-1-yl)-6-(dichloromethyl)-2-phenyl-5-nitropyrimidine
SpectraBase Compound ID KsknUMVvTVP
InChI InChI=1S/C17H10Cl2N6O2/c18-15(19)13-14(25(26)27)17(21-16(20-13)10-6-2-1-3-7-10)24-12-9-5-4-8-11(12)22-23-24/h1-9,15H
InChIKey IDVRGTDMBKFVPV-UHFFFAOYSA-N
Mol Weight 401.21 g/mol
Molecular Formula C17H10Cl2N6O2
Exact Mass 400.024229 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Bc4H5f9VEb7
Name 4-(1H-Benzotriazol-1-yl)-6-(dichloromethyl)-2-phenyl-5-nitropyrimidine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H10Cl2N6O2
InChI InChI=1S/C17H10Cl2N6O2/c18-15(19)13-14(25(26)27)17(21-16(20-13)10-6-2-1-3-7-10)24-12-9-5-4-8-11(12)22-23-24/h1-9,15H
InChIKey IDVRGTDMBKFVPV-UHFFFAOYSA-N
Molecular Weight 401.213 g/mol
SMILES c1(-[n]2nnc3c2cccc3)c(c(C(Cl)Cl)nc(n1)-c1ccccc1)N(=O)=O
SPLASH splash10-0006-9021200000-5e7c5dc2f87f67693dfb
Source of Spectrum F4-40-308-12
Synonyms 1-[6-(dichloromethyl)-5-nitro-2-phenyl-4-pyrimidinyl]benzotriazole 1-[6-(dichloromethyl)-5-nitro-2-phenylpyrimidin-4-yl]benzotriazole 1-[6-[bis(chloranyl)methyl]-5-nitro-2-phenyl-pyrimidin-4-yl]benzotriazole
Wiley ID 1670183