CID 43383812

N-[(2-aminophenyl)methyl]-n-methylcyclohexanecarboxamide

Structural Information

Molecular Formula
C15H22N2O
SMILES
CN(CC1=CC=CC=C1N)C(=O)C2CCCCC2
InChI
InChI=1S/C15H22N2O/c1-17(11-13-9-5-6-10-14(13)16)15(18)12-7-3-2-4-8-12/h5-6,9-10,12H,2-4,7-8,11,16H2,1H3
InChIKey
TZTMVWNGORTJHN-UHFFFAOYSA-N
Compound name
N-[(2-aminophenyl)methyl]-N-methylcyclohexanecarboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

246.17322 Da
Monoisotopic Mass

2.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 247.180496 159.3
[M+Na]+ 269.162438 161.7
[M-H]- 245.165944 165.5
[M+NH4]+ 264.207043 175.8
[M+K]+ 285.136378 159.7
[M+H-H2O]+ 229.170480 151.1
[M+HCOO]- 291.171421 180.3
[M+CH3COO]- 305.187071 201.2
[M+Na-2H]- 267.147886 160.8
[M]+ 246.17267142 153.6
[M]- 246.17376858 153.6
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

No patent data available for this compound.