CID 18401744

4-amino-2-methylcyclohexan-1-ol

Structural Information

Molecular Formula
C7H15NO
SMILES
CC1CC(CCC1O)N
InChI
InChI=1S/C7H15NO/c1-5-4-6(8)2-3-7(5)9/h5-7,9H,2-4,8H2,1H3
InChIKey
GEVHPGXCGOVPDK-UHFFFAOYSA-N
Compound name
4-amino-2-methylcyclohexan-1-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

48
Patents

129.11537 Da
Monoisotopic Mass

0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 130.12265 127.0
[M+Na]+ 152.10459 136.8
[M+NH4]+ 147.14919 135.9
[M+K]+ 168.07853 131.7
[M-H]- 128.10809 129.2
[M+Na-2H]- 150.09004 131.4
[M]+ 129.11482 128.7
[M]- 129.11592 128.7
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