CID 65917740

4-amino-1-(propan-2-yl)cyclohexan-1-ol hydrochloride

Structural Information

Molecular Formula
C9H19NO
SMILES
CC(C)C1(CCC(CC1)N)O
InChI
InChI=1S/C9H19NO/c1-7(2)9(11)5-3-8(10)4-6-9/h7-8,11H,3-6,10H2,1-2H3
InChIKey
RJRRWCVYXLMUJD-UHFFFAOYSA-N
Compound name
4-amino-1-propan-2-ylcyclohexan-1-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

18
Patents

157.14667 Da
Monoisotopic Mass

1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 158.15395 137.5
[M+Na]+ 180.13589 142.1
[M-H]- 156.13939 138.7
[M+NH4]+ 175.18049 159.2
[M+K]+ 196.10983 140.9
[M+H-H2O]+ 140.14393 133.1
[M+HCOO]- 202.14487 155.7
[M+CH3COO]- 216.16052 177.6
[M+Na-2H]- 178.12134 140.6
[M]+ 157.14612 130.9
[M]- 157.14722 130.9
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