CID 42925021

1050830-18-6

Structural Information

Molecular Formula
C11H14N2O2
SMILES
CC(C1CC1)NC(=O)C2=CC=CNC2=O
InChI
InChI=1S/C11H14N2O2/c1-7(8-4-5-8)13-11(15)9-3-2-6-12-10(9)14/h2-3,6-8H,4-5H2,1H3,(H,12,14)(H,13,15)
InChIKey
JWAIUNSAJMVLEO-UHFFFAOYSA-N
Compound name
N-(1-cyclopropylethyl)-2-oxo-1H-pyridine-3-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

206.10553 Da
Monoisotopic Mass

1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 207.11281 144.6
[M+Na]+ 229.09475 152.9
[M-H]- 205.09825 149.6
[M+NH4]+ 224.13935 156.5
[M+K]+ 245.06869 148.6
[M+H-H2O]+ 189.10279 137.4
[M+HCOO]- 251.10373 166.3
[M+CH3COO]- 265.11938 188.5
[M+Na-2H]- 227.08020 149.1
[M]+ 206.10498 145.0
[M]- 206.10608 145.0
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.