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N-{2-[(cyclopropylcarbonyl)amino]ethyl}isonicotinamide
SpectraBase Compound ID 6l9WCsc5BWF
InChI InChI=1S/C12H15N3O2/c16-11(9-1-2-9)14-7-8-15-12(17)10-3-5-13-6-4-10/h3-6,9H,1-2,7-8H2,(H,14,16)(H,15,17)
InChIKey FZIZTHXETZQHBE-UHFFFAOYSA-N
Mol Weight 233.27 g/mol
Molecular Formula C12H15N3O2
Exact Mass 233.116427 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1aOxxBOrfG1
Name N-{2-[(Cyclopropylcarbonyl)amino]ethyl}isonicotinamide
Comments Computed using HOSE algorithm
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Exact Mass 233.116426733 u
Formula C12H15N3O2
InChI InChI=1S/C12H15N3O2/c16-11(9-1-2-9)14-7-8-15-12(17)10-3-5-13-6-4-10/h3-6,9H,1-2,7-8H2,(H,14,16)(H,15,17)
InChIKey FZIZTHXETZQHBE-UHFFFAOYSA-N
SMILES N(C(C1CC1)=O)CCNC(=O)C=1C=CN=CC1