CID 121553401

{1-[amino(phenyl)methyl]cyclohexyl}methanol hydrochloride

Structural Information

Molecular Formula
C14H21NO
SMILES
C1CCC(CC1)(CO)C(C2=CC=CC=C2)N
InChI
InChI=1S/C14H21NO/c15-13(12-7-3-1-4-8-12)14(11-16)9-5-2-6-10-14/h1,3-4,7-8,13,16H,2,5-6,9-11,15H2
InChIKey
RHSYYPIQBHUJEE-UHFFFAOYSA-N
Compound name
[1-[amino(phenyl)methyl]cyclohexyl]methanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

219.16231 Da
Monoisotopic Mass

2.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 220.16959 153.6
[M+Na]+ 242.15153 164.0
[M+NH4]+ 237.19613 163.9
[M+K]+ 258.12547 155.4
[M-H]- 218.15503 158.0
[M+Na-2H]- 240.13698 162.0
[M]+ 219.16176 156.4
[M]- 219.16286 156.4
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.