CID 80559136

4-amino-1-cyclopropylcyclohexan-1-ol

Structural Information

Molecular Formula
C9H17NO
SMILES
C1CC1C2(CCC(CC2)N)O
InChI
InChI=1S/C9H17NO/c10-8-3-5-9(11,6-4-8)7-1-2-7/h7-8,11H,1-6,10H2
InChIKey
ICWOORLJGLNJSQ-UHFFFAOYSA-N
Compound name
4-amino-1-cyclopropylcyclohexan-1-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

155.13101 Da
Monoisotopic Mass

0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 156.138286 132.5
[M+Na]+ 178.120228 139.4
[M-H]- 154.123734 138.0
[M+NH4]+ 173.164833 149.3
[M+K]+ 194.094168 137.3
[M+H-H2O]+ 138.128270 127.6
[M+HCOO]- 200.129211 152.1
[M+CH3COO]- 214.144861 178.8
[M+Na-2H]- 176.105676 137.7
[M]+ 155.13046142 128.4
[M]- 155.13155858 128.4
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