CID 3039766

4-amino-1-phenylcyclohexan-1-ol

Structural Information

Molecular Formula
C12H17NO
SMILES
C1CC(CCC1N)(C2=CC=CC=C2)O
InChI
InChI=1S/C12H17NO/c13-11-6-8-12(14,9-7-11)10-4-2-1-3-5-10/h1-5,11,14H,6-9,13H2
InChIKey
IUECPDWEFSCXJG-UHFFFAOYSA-N
Compound name
4-amino-1-phenylcyclohexan-1-ol
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

21
Patents

191.13101 Da
Monoisotopic Mass

1.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 192.138286 143.5
[M+Na]+ 214.120228 148.6
[M-H]- 190.123734 147.9
[M+NH4]+ 209.164833 163.5
[M+K]+ 230.094168 145.3
[M+H-H2O]+ 174.128270 137.4
[M+HCOO]- 236.129211 163.4
[M+CH3COO]- 250.144861 181.4
[M+Na-2H]- 212.105676 148.8
[M]+ 191.13046142 136.2
[M]- 191.13155858 136.2
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