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1H-[1,2,3]Triazole-4-carboxylic acid, 5-chloromethyl-1-(4-pyrrol-1-yl-furazan-3-yl)-, ethyl ester
SpectraBase Compound ID olS0o8XVNV
InChI InChI=1S/C12H11ClN6O3/c1-2-21-12(20)9-8(7-13)19(17-14-9)11-10(15-22-16-11)18-5-3-4-6-18/h3-6H,2,7H2,1H3
InChIKey WDPUQPVIFCAYLD-UHFFFAOYSA-N
Mol Weight 322.71 g/mol
Molecular Formula C12H11ClN6O3
Exact Mass 322.058116 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1YV4lmU0lDY
Name 1H-[1,2,3]Triazole-4-carboxylic acid, 5-chloromethyl-1-(4-pyrrol-1-yl-furazan-3-yl)-, ethyl ester
Alternate Name(s) 5-(chloromethyl)-1-(4-pyrrol-1-ylfurazan-3-yl)triazole-4-carboxylic acid ethyl ester 5-(chloromethyl)-1-[4-(1-pyrrolyl)-1,2,5-oxadiazol-3-yl]-4-triazolecarboxylic acid ethyl ester Ethyl 5-(chloromethyl)-1-(4-pyrrol-1-yl-1,2,5-oxadiazol-3-yl)-1,2,3-triazole-4-carboxylate Ethyl 5-(chloromethyl)-1-(4-pyrrol-1-yl-1,2,5-oxadiazol-3-yl)triazole-4-carboxylate Ethyl 5-(chloromethyl)-1-[4-(1H-pyrrol-1-yl)-1,2,5-oxadiazol-3-yl]-1H-1,2,3-triazole-4-carboxylate
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Formula C12H11ClN6O3
InChI InChI=1S/C12H11ClN6O3/c1-2-21-12(20)9-8(7-13)19(17-14-9)11-10(15-22-16-11)18-5-3-4-6-18/h3-6H,2,7H2,1H3
InChIKey WDPUQPVIFCAYLD-UHFFFAOYSA-N
Molecular Weight 322.712 g/mol
SMILES CCOC(c1c([n](-c2c(non2)-[n]2cccc2)nn1)CCl)=O
SPLASH splash10-001i-3590000000-cddc9b0c3360be187f68
Wiley ID 1441495