CID 26276

13799-54-7

Structural Information

Molecular Formula
C19H20N2O
SMILES
CC(C(C1=CC=CC=C1)O)NCC2=NC3=CC=CC=C3C=C2
InChI
InChI=1S/C19H20N2O/c1-14(19(22)16-8-3-2-4-9-16)20-13-17-12-11-15-7-5-6-10-18(15)21-17/h2-12,14,19-20,22H,13H2,1H3
InChIKey
UCJJGZPAWOFIPW-UHFFFAOYSA-N
Compound name
1-phenyl-2-(quinolin-2-ylmethylamino)propan-1-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

292.15756 Da
Monoisotopic Mass

2.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 293.16484 169.0
[M+Na]+ 315.14678 173.6
[M-H]- 291.15028 173.1
[M+NH4]+ 310.19138 182.3
[M+K]+ 331.12072 168.3
[M+H-H2O]+ 275.15482 159.8
[M+HCOO]- 337.15576 187.7
[M+CH3COO]- 351.17141 178.6
[M+Na-2H]- 313.13223 174.6
[M]+ 292.15701 166.9
[M]- 292.15811 166.9
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

No patent data available for this compound.