CID 41041

Brn 0406616

Structural Information

Molecular Formula
C14H21N3O
SMILES
CC(CN1CCCCC1)N(C=O)C2=CC=CC=N2
InChI
InChI=1S/C14H21N3O/c1-13(11-16-9-5-2-6-10-16)17(12-18)14-7-3-4-8-15-14/h3-4,7-8,12-13H,2,5-6,9-11H2,1H3
InChIKey
VAKUUNUZJHKANX-UHFFFAOYSA-N
Compound name
N-(1-piperidin-1-ylpropan-2-yl)-N-pyridin-2-ylformamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

247.16846 Da
Monoisotopic Mass

1.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 248.17574 158.9
[M+Na]+ 270.15768 161.6
[M-H]- 246.16118 162.5
[M+NH4]+ 265.20228 172.8
[M+K]+ 286.13162 159.7
[M+H-H2O]+ 230.16572 148.9
[M+HCOO]- 292.16666 177.2
[M+CH3COO]- 306.18231 198.7
[M+Na-2H]- 268.14313 162.6
[M]+ 247.16791 155.3
[M]- 247.16901 155.3
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.