CID 81293

Trans-4-aminocyclohexanol

Structural Information

Molecular Formula
C6H13NO
SMILES
C1CC(CCC1N)O
InChI
InChI=1S/C6H13NO/c7-5-1-3-6(8)4-2-5/h5-6,8H,1-4,7H2
InChIKey
IMLXLGZJLAOKJN-UHFFFAOYSA-N
Compound name
4-aminocyclohexan-1-ol
Related CIDs

2D Structure

compound 2d structure
3
Annotation Hits

8
References

10282
Patents

115.09972 Da
Monoisotopic Mass

-0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 116.10700 123.0
[M+Na]+ 138.08894 132.6
[M+NH4]+ 133.13354 132.0
[M+K]+ 154.06288 127.5
[M-H]- 114.09244 125.1
[M+Na-2H]- 136.07439 127.8
[M]+ 115.09917 124.7
[M]- 115.10027 124.7
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