CID 21291621

2253632-25-4

Structural Information

Molecular Formula
C8H17NO
SMILES
CC1(CC(CCC1O)N)C
InChI
InChI=1S/C8H17NO/c1-8(2)5-6(9)3-4-7(8)10/h6-7,10H,3-5,9H2,1-2H3
InChIKey
WZDISXGBYPFZIO-UHFFFAOYSA-N
Compound name
4-amino-2,2-dimethylcyclohexan-1-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

51
Patents

143.13101 Da
Monoisotopic Mass

0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 144.13829 131.3
[M+Na]+ 166.12023 141.0
[M+NH4]+ 161.16483 141.4
[M+K]+ 182.09417 134.0
[M-H]- 142.12373 133.4
[M+Na-2H]- 164.10568 137.0
[M]+ 143.13046 133.2
[M]- 143.13156 133.2
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