CID 4188985

1-(n-(o-tolyl)carbamoyl)piperidine

Structural Information

Molecular Formula
C13H18N2O
SMILES
CC1=CC=CC=C1NC(=O)N2CCCCC2
InChI
InChI=1S/C13H18N2O/c1-11-7-3-4-8-12(11)14-13(16)15-9-5-2-6-10-15/h3-4,7-8H,2,5-6,9-10H2,1H3,(H,14,16)
InChIKey
BTBNZCCPHWAHGE-UHFFFAOYSA-N
Compound name
N-(2-methylphenyl)piperidine-1-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

20
Patents

218.1419 Da
Monoisotopic Mass

1.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 219.149176 150.8
[M+Na]+ 241.131118 155.0
[M-H]- 217.134624 155.2
[M+NH4]+ 236.175723 167.2
[M+K]+ 257.105058 152.1
[M+H-H2O]+ 201.139160 142.6
[M+HCOO]- 263.140101 170.4
[M+CH3COO]- 277.155751 189.3
[M+Na-2H]- 239.116566 154.9
[M]+ 218.14135142 145.3
[M]- 218.14244858 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