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Methyl 1-(4-Chlorophenyl)-1H-1,2,4-triazole-3-carboxylate
SpectraBase Compound ID 4CuQkv7akiY
InChI InChI=1S/C10H8ClN3O2/c1-16-10(15)9-12-6-14(13-9)8-4-2-7(11)3-5-8/h2-6H,1H3
InChIKey RNUZXNJICZHTNP-UHFFFAOYSA-N
Mol Weight 237.65 g/mol
Molecular Formula C10H8ClN3O2
Exact Mass 237.030504 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AFiDcscF8vy
Name Methyl 1-(4-Chlorophenyl)-1H-1,2,4-triazole-3-carboxylate
Appearance Light yellow solid
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Formula C10H8ClN3O2
InChI InChI=1S/C10H8ClN3O2/c1-16-10(15)9-12-6-14(13-9)8-4-2-7(11)3-5-8/h2-6H,1H3
InChIKey RNUZXNJICZHTNP-UHFFFAOYSA-N
Instrument Name JEOL JMS-HX110
Ionization Type EI
Literature Reference DOI 10.1002/ejoc.201801808
Molecular Weight 237.646 g/mol
Reported Formula C10H8ClN3O2
SMILES COC(=O)c1n[n](cn1)-c1ccc(cc1)Cl
SPLASH splash10-004r-2950000000-10d2f642c7c42233c14f
Source of Spectrum U1-2019-1759-2i
Wiley ID 1846112