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2-((4-(2-methoxyethyl)-5-(methoxymethyl)-4H-1,2,4-triazol-3-yl)thio)-3-nitropyridine

View entire compound with spectra: 2 MS (GC)

2-((4-(2-methoxyethyl)-5-(methoxymethyl)-4H-1,2,4-triazol-3-yl)thio)-3-nitropyridine
SpectraBase Compound ID 6aALr0123qP
InChI InChI=1S/C12H15N5O4S/c1-20-7-6-16-10(8-21-2)14-15-12(16)22-11-9(17(18)19)4-3-5-13-11/h3-5H,6-8H2,1-2H3
InChIKey JDOJVUBAFNBTIE-UHFFFAOYSA-N
Mol Weight 325.34 g/mol
Molecular Formula C12H15N5O4S
Exact Mass 325.084475 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Ik2kMZ2eiaq
Name 2-((4-(2-methoxyethyl)-5-(methoxymethyl)-4H-1,2,4-triazol-3-yl)thio)-3-nitropyridine
Alternate Name(s) 2-{[4-(2-methoxyethyl)-5-(methoxymethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-3-nitropyridine 2-[[4-(2-methoxyethyl)-5-(methoxymethyl)-1,2,4-triazol-3-yl]thio]-3-nitropyridine 2-[[4-(2-methoxyethyl)-5-(methoxymethyl)-1,2,4-triazol-3-yl]sulfanyl]-3-nitropyridine 2-[[4-(2-methoxyethyl)-5-(methoxymethyl)-1,2,4-triazol-3-yl]sulfanyl]-3-nitro-pyridine
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Formula C12H15N5O4S
InChI InChI=1S/C12H15N5O4S/c1-20-7-6-16-10(8-21-2)14-15-12(16)22-11-9(17(18)19)4-3-5-13-11/h3-5H,6-8H2,1-2H3
InChIKey JDOJVUBAFNBTIE-UHFFFAOYSA-N
Molecular Weight 325.343 g/mol
SMILES COCC[n]1c(COC)nnc1Sc1ncccc1[N+]([O-])=O
SPLASH splash10-000j-9610000000-52654e37a97606cc4078
Source of Spectrum JX-2015-3-402
Wiley ID 1723972