CID 16770188

2-(3,5-dimethylpiperidine-1-carbonyl)aniline

Structural Information

Molecular Formula
C14H20N2O
SMILES
CC1CC(CN(C1)C(=O)C2=CC=CC=C2N)C
InChI
InChI=1S/C14H20N2O/c1-10-7-11(2)9-16(8-10)14(17)12-5-3-4-6-13(12)15/h3-6,10-11H,7-9,15H2,1-2H3
InChIKey
HBRDSVZHQXKCKQ-UHFFFAOYSA-N
Compound name
(2-aminophenyl)-(3,5-dimethylpiperidin-1-yl)methanone
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

232.15756 Da
Monoisotopic Mass

3.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 233.16484 155.7
[M+Na]+ 255.14678 161.3
[M-H]- 231.15028 160.2
[M+NH4]+ 250.19138 171.9
[M+K]+ 271.12072 157.9
[M+H-H2O]+ 215.15482 147.8
[M+HCOO]- 277.15576 174.3
[M+CH3COO]- 291.17141 194.8
[M+Na-2H]- 253.13223 156.8
[M]+ 232.15701 150.5
[M]- 232.15811 150.5
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.