CID 13071

N-cyclohexyl-4-methoxyaniline hydrochloride

Structural Information

Molecular Formula
C13H19NO
SMILES
COC1=CC=C(C=C1)NC2CCCCC2
InChI
InChI=1S/C13H19NO/c1-15-13-9-7-12(8-10-13)14-11-5-3-2-4-6-11/h7-11,14H,2-6H2,1H3
InChIKey
BCEHDRNCEWCNIW-UHFFFAOYSA-N
Compound name
N-cyclohexyl-4-methoxyaniline
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

157
Patents

205.14667 Da
Monoisotopic Mass

3.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 206.15395 146.4
[M+Na]+ 228.13589 150.4
[M-H]- 204.13939 152.1
[M+NH4]+ 223.18049 164.7
[M+K]+ 244.10983 147.8
[M+H-H2O]+ 188.14393 139.0
[M+HCOO]- 250.14487 168.1
[M+CH3COO]- 264.16052 188.0
[M+Na-2H]- 226.12134 151.7
[M]+ 205.14612 141.9
[M]- 205.14722 141.9
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

patents stripe