CID 23286

2-aminocyclohexanol

Structural Information

Molecular Formula
C6H13NO
SMILES
C1CCC(C(C1)N)O
InChI
InChI=1S/C6H13NO/c7-5-3-1-2-4-6(5)8/h5-6,8H,1-4,7H2
InChIKey
PQMCFTMVQORYJC-UHFFFAOYSA-N
Compound name
2-aminocyclohexan-1-ol
Related CIDs

2D Structure

compound 2d structure
3
Annotation Hits

15
References

5754
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 123.9
[M+Na]+ 138.08894 129.1
[M-H]- 114.09244 125.2
[M+NH4]+ 133.13354 145.2
[M+K]+ 154.06288 127.8
[M+H-H2O]+ 98.096980 118.9
[M+HCOO]- 160.09792 144.1
[M+CH3COO]- 174.11357 167.9
[M+Na-2H]- 136.07439 128.6
[M]+ 115.09917 116.5
[M]- 115.10027 116.5
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.