CID 772233

1-(3-methylbenzoyl)piperidine-4-carboxamide

Structural Information

Molecular Formula
C14H18N2O2
SMILES
CC1=CC(=CC=C1)C(=O)N2CCC(CC2)C(=O)N
InChI
InChI=1S/C14H18N2O2/c1-10-3-2-4-12(9-10)14(18)16-7-5-11(6-8-16)13(15)17/h2-4,9,11H,5-8H2,1H3,(H2,15,17)
InChIKey
VSYPROQBASLXDK-UHFFFAOYSA-N
Compound name
1-(3-methylbenzoyl)piperidine-4-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

246.13683 Da
Monoisotopic Mass

1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 247.14411 157.5
[M+Na]+ 269.12605 162.1
[M-H]- 245.12955 161.7
[M+NH4]+ 264.17065 172.5
[M+K]+ 285.09999 159.2
[M+H-H2O]+ 229.13409 149.4
[M+HCOO]- 291.13503 175.5
[M+CH3COO]- 305.15068 195.8
[M+Na-2H]- 267.11150 158.2
[M]+ 246.13628 152.1
[M]- 246.13738 152.1
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.