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1-[1'-(Ethoxycarbonyl)methyl]-4-(ethoxycarbonyl)-1,2,3-triazole
SpectraBase Compound ID DHHIBaTcADs
InChI InChI=1S/C9H13N3O4/c1-3-15-8(13)6-12-5-7(10-11-12)9(14)16-4-2/h5H,3-4,6H2,1-2H3
InChIKey DQGUCMQCGSFBOW-UHFFFAOYSA-N
Mol Weight 227.22 g/mol
Molecular Formula C9H13N3O4
Exact Mass 227.090606 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JKeW68xQs2P
Name 1-[1'-(Ethoxycarbonyl)methyl]-4-(ethoxycarbonyl)-1,2,3-triazole
Comments Less than 3 mono-isotopic peaks; Note: The molecular formula of the structure shown is C9H13N3O4 - which differs from the formula reported for the mass spectrum (C10H15N3O4)
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Formula C10H15N3O4
InChI InChI=1S/C9H13N3O4/c1-3-15-8(13)6-12-5-7(10-11-12)9(14)16-4-2/h5H,3-4,6H2,1-2H3
InChIKey DQGUCMQCGSFBOW-UHFFFAOYSA-N
Molecular Weight 227.220 g/mol
SMILES C(C)OC(=O)C[n]1nnc(c1)C(=O)OCC
SPLASH splash10-03di-0090000000-6d62cd087596a9ea6f80
Source of Spectrum OP-27-609-3
Synonyms 1-[(Ethoxycarbonyl)methyl]-4-(ethoxycarbonyl)-1,2,3-triazole ethyl 1-(2-ethoxy-2-oxoethyl)-1H-1,2,3-triazole-4-carboxylate
Wiley ID 850635