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]+ 196.20598 149.9
[M+Na]+ 218.18792 150.7
[M-H]- 194.19142 153.8
[M+NH4]+ 213.23252 169.7
[M+K]+ 234.16186 148.2
[M+H-H2O]+ 178.19596 143.0
[M+HCOO]- 240.19690 166.2
[M+CH3COO]- 254.21255 184.9
[M+Na-2H]- 216.17337 152.5
[M]+ 195.19815 138.4
[M]- 195.19925 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