CID 16784264

4-methyl-n-(piperidin-4-yl)benzamide hydrochloride

Structural Information

Molecular Formula
C13H18N2O
SMILES
CC1=CC=C(C=C1)C(=O)NC2CCNCC2
InChI
InChI=1S/C13H18N2O/c1-10-2-4-11(5-3-10)13(16)15-12-6-8-14-9-7-12/h2-5,12,14H,6-9H2,1H3,(H,15,16)
InChIKey
YOEGOTABDHBSJE-UHFFFAOYSA-N
Compound name
4-methyl-N-piperidin-4-ylbenzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

42
Patents

218.1419 Da
Monoisotopic Mass

1.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 219.14918 150.9
[M+Na]+ 241.13112 154.5
[M-H]- 217.13462 153.8
[M+NH4]+ 236.17572 166.5
[M+K]+ 257.10506 150.8
[M+H-H2O]+ 201.13916 142.9
[M+HCOO]- 263.14010 168.9
[M+CH3COO]- 277.15575 187.5
[M+Na-2H]- 239.11657 154.6
[M]+ 218.14135 143.7
[M]- 218.14245 143.7
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