CID 22365089

(1-cyclohexylcyclohexyl)methanamine hydrochloride

Structural Information

Molecular Formula
C13H25N
SMILES
C1CCC(CC1)C2(CCCCC2)CN
InChI
InChI=1S/C13H25N/c14-11-13(9-5-2-6-10-13)12-7-3-1-4-8-12/h12H,1-11,14H2
InChIKey
FYNYEZQHKOXSEH-UHFFFAOYSA-N
Compound name
(1-cyclohexylcyclohexyl)methanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

5
Patents

195.1987 Da
Monoisotopic Mass

4.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 196.205976 149.9
[M+Na]+ 218.187918 150.7
[M-H]- 194.191424 153.8
[M+NH4]+ 213.232523 169.7
[M+K]+ 234.161858 148.2
[M+H-H2O]+ 178.195960 143.0
[M+HCOO]- 240.196901 166.2
[M+CH3COO]- 254.212551 184.9
[M+Na-2H]- 216.173366 152.5
[M]+ 195.19815142 138.4
[M]- 195.19924858 138.4
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