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5-chloranyl-1-[(4-methoxyphenyl)methyl]-1,2,3-triazole-4-carbonyl chloride
SpectraBase Compound ID 15V3koqTYZK
InChI InChI=1S/C11H9Cl2N3O2/c1-18-8-4-2-7(3-5-8)6-16-10(12)9(11(13)17)14-15-16/h2-5H,6H2,1H3
InChIKey NTDVRGCKZRXVHJ-UHFFFAOYSA-N
Mol Weight 286.12 g/mol
Molecular Formula C11H9Cl2N3O2
Exact Mass 285.007182 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID A2PclKsRab7
Name 5-chloranyl-1-[(4-methoxyphenyl)methyl]-1,2,3-triazole-4-carbonyl chloride
Alternate Name(s) 5-chloro-1-p-anisyl-triazole-4-carbonyl chloride 5-chloro-1-[(4-methoxyphenyl)methyl]-4-triazolecarbonyl chloride 5-chloro-1-[(4-methoxyphenyl)methyl]triazole-4-carbonyl chloride
CAS Registry Number 96938-91-9
Comments Less than 3 mono-isotopic peaks
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Formula C11H9Cl2N3O2
InChI InChI=1S/C11H9Cl2N3O2/c1-18-8-4-2-7(3-5-8)6-16-10(12)9(11(13)17)14-15-16/h2-5H,6H2,1H3
InChIKey NTDVRGCKZRXVHJ-UHFFFAOYSA-N
Molecular Weight 286.118 g/mol
SMILES c1(c([n](Cc2ccc(cc2)OC)nn1)Cl)C(=O)Cl
SPLASH splash10-00di-0900000000-0557b5281f6b8d2be3d0
Source of Spectrum Y-22-1699-7
Wiley ID 1288696