CID 95228

Cyclohexanecarboxamide, n-(p-tolyl)-

Structural Information

Molecular Formula
C14H19NO
SMILES
CC1=CC=C(C=C1)NC(=O)C2CCCCC2
InChI
InChI=1S/C14H19NO/c1-11-7-9-13(10-8-11)15-14(16)12-5-3-2-4-6-12/h7-10,12H,2-6H2,1H3,(H,15,16)
InChIKey
CAKLGRXELZTXPH-UHFFFAOYSA-N
Compound name
N-(4-methylphenyl)cyclohexanecarboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

49
Patents

217.14667 Da
Monoisotopic Mass

3.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 218.15395 150.5
[M+Na]+ 240.13589 154.2
[M-H]- 216.13939 156.2
[M+NH4]+ 235.18049 168.2
[M+K]+ 256.10983 151.3
[M+H-H2O]+ 200.14393 143.2
[M+HCOO]- 262.14487 171.1
[M+CH3COO]- 276.16052 190.4
[M+Na-2H]- 238.12134 154.0
[M]+ 217.14612 145.0
[M]- 217.14722 145.0
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