CID 1132825

4-(4-methylpiperidine-1-carbonyl)aniline

Structural Information

Molecular Formula
C13H18N2O
SMILES
CC1CCN(CC1)C(=O)C2=CC=C(C=C2)N
InChI
InChI=1S/C13H18N2O/c1-10-6-8-15(9-7-10)13(16)11-2-4-12(14)5-3-11/h2-5,10H,6-9,14H2,1H3
InChIKey
SOVNVUQEIMQSDL-UHFFFAOYSA-N
Compound name
(4-aminophenyl)-(4-methylpiperidin-1-yl)methanone
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

4
Patents

218.1419 Da
Monoisotopic Mass

2.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 219.14918 151.2
[M+Na]+ 241.13112 156.3
[M-H]- 217.13462 155.5
[M+NH4]+ 236.17572 167.6
[M+K]+ 257.10506 153.1
[M+H-H2O]+ 201.13916 143.3
[M+HCOO]- 263.14010 170.1
[M+CH3COO]- 277.15575 190.6
[M+Na-2H]- 239.11657 153.5
[M]+ 218.14135 145.3
[M]- 218.14245 145.3
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

patents stripe