CID 24131540

4-[(4-methylcyclohexyl)amino]cyclohexan-1-ol

Structural Information

Molecular Formula
C13H25NO
SMILES
CC1CCC(CC1)NC2CCC(CC2)O
InChI
InChI=1S/C13H25NO/c1-10-2-4-11(5-3-10)14-12-6-8-13(15)9-7-12/h10-15H,2-9H2,1H3
InChIKey
MTMTYFVAPKIEOQ-UHFFFAOYSA-N
Compound name
4-[(4-methylcyclohexyl)amino]cyclohexan-1-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

211.19362 Da
Monoisotopic Mass

2.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 212.20090 152.1
[M+Na]+ 234.18284 153.5
[M-H]- 210.18634 155.6
[M+NH4]+ 229.22744 169.4
[M+K]+ 250.15678 150.7
[M+H-H2O]+ 194.19088 145.3
[M+HCOO]- 256.19182 167.8
[M+CH3COO]- 270.20747 187.8
[M+Na-2H]- 232.16829 153.1
[M]+ 211.19307 141.8
[M]- 211.19417 141.8
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.