CID 82283870

(1-aminocyclopentyl)(4-fluorophenyl)methanol hydrochloride

Structural Information

Molecular Formula
C12H16FNO
SMILES
C1CCC(C1)(C(C2=CC=C(C=C2)F)O)N
InChI
InChI=1S/C12H16FNO/c13-10-5-3-9(4-6-10)11(15)12(14)7-1-2-8-12/h3-6,11,15H,1-2,7-8,14H2
InChIKey
VKZQCCQUBGRSDB-UHFFFAOYSA-N
Compound name
(1-aminocyclopentyl)-(4-fluorophenyl)methanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

209.1216 Da
Monoisotopic Mass

1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 210.128876 146.4
[M+Na]+ 232.110818 152.2
[M-H]- 208.114324 149.8
[M+NH4]+ 227.155423 167.5
[M+K]+ 248.084758 148.7
[M+H-H2O]+ 192.118860 139.8
[M+HCOO]- 254.119801 166.5
[M+CH3COO]- 268.135451 184.5
[M+Na-2H]- 230.096266 148.6
[M]+ 209.12105142 139.5
[M]- 209.12214858 139.5
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

No patent data available for this compound.