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1'-Methylethyl 4,5-dihydro-3-(1"-methylethoxy)-5-oxo-4-butyl-1H-1,2,4-triazole-1-carboxylate

View entire compound with spectra: 1 MS (GC)

1'-Methylethyl 4,5-dihydro-3-(1"-methylethoxy)-5-oxo-4-butyl-1H-1,2,4-triazole-1-carboxylate
SpectraBase Compound ID 1JOI9ybrlUI
InChI InChI=1S/C13H23N3O4/c1-6-7-8-15-11(19-9(2)3)14-16(12(15)17)13(18)20-10(4)5/h9-10H,6-8H2,1-5H3
InChIKey FPCGDLSNRRCKME-UHFFFAOYSA-N
Mol Weight 285.34 g/mol
Molecular Formula C13H23N3O4
Exact Mass 285.168856 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6lsZomthfVG
Name 1'-Methylethyl 4,5-dihydro-3-(1"-methylethoxy)-5-oxo-4-butyl-1H-1,2,4-triazole-1-carboxylate
Alternate Name(s) isopropyl 4-butyl-3-isopropoxy-5-oxo-4,5-dihydro-1H-1,2,4-triazole-1-carboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H23N3O4
InChI InChI=1S/C13H23N3O4/c1-6-7-8-15-11(19-9(2)3)14-16(12(15)17)13(18)20-10(4)5/h9-10H,6-8H2,1-5H3
InChIKey FPCGDLSNRRCKME-UHFFFAOYSA-N
Molecular Weight 285.344 g/mol
SMILES C1(N(N=C(N1CCCC)OC(C)C)C(OC(C)C)=O)=O
SPLASH splash10-0f7c-2690000000-241a5366c747c9e1a2e3
Source of Spectrum C-88-2780-2
Wiley ID 1590382