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3-(5-Amino-1H-1,2,4-triazol-3-yl)-N-benzylpropanamide
SpectraBase Compound ID KwMC5ZUXrsX
InChI InChI=1S/C12H15N5O/c13-12-15-10(16-17-12)6-7-11(18)14-8-9-4-2-1-3-5-9/h1-5H,6-8H2,(H,14,18)(H3,13,15,16,17)
InChIKey SYDQVPWHBAURAB-UHFFFAOYSA-N
Mol Weight 245.29 g/mol
Molecular Formula C12H15N5O
Exact Mass 245.12766 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EucJweRZp9c
Name 3-(5-Amino-1H-1,2,4-triazol-3-yl)-N-benzylpropanamide
Alternate Name(s) 3-(3-amino-1H-1,2,4-triazol-5-yl)-N-(phenylmethyl)propanamide 3-(3-amino-1H-1,2,4-triazol-5-yl)-N-benzylpropanamide 3-(3-amino-1H-1,2,4-triazol-5-yl)-N-benzyl-propanamide 3-(3-azanyl-1H-1,2,4-triazol-5-yl)-N-(phenylmethyl)propanamide
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Formula C12H15N5O
InChI InChI=1S/C12H15N5O/c13-12-15-10(16-17-12)6-7-11(18)14-8-9-4-2-1-3-5-9/h1-5H,6-8H2,(H,14,18)(H3,13,15,16,17)
InChIKey SYDQVPWHBAURAB-UHFFFAOYSA-N
Molecular Weight 245.286 g/mol
SMILES [nH]1nc(nc1N)CCC(NCc1ccccc1)=O
SPLASH splash10-03dl-5910000000-797af10c092a16fa9719
Source of Spectrum HC-46-628-4b
Wiley ID 1739079