CID 3056877

Brn 0316474

Structural Information

Molecular Formula
C22H19N3O
SMILES
CC1=C(N=CC=C1)NC(C2=CC=CC=C2)C3=C(C4=C(C=CC=N4)C=C3)O
InChI
InChI=1S/C22H19N3O/c1-15-7-5-14-24-22(15)25-19(16-8-3-2-4-9-16)18-12-11-17-10-6-13-23-20(17)21(18)26/h2-14,19,26H,1H3,(H,24,25)
InChIKey
WKQUEMVLENNTJC-UHFFFAOYSA-N
Compound name
7-[[(3-methylpyridin-2-yl)amino]-phenylmethyl]quinolin-8-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

4
Patents

341.1528 Da
Monoisotopic Mass

4.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 342.16008 183.8
[M+Na]+ 364.14202 201.1
[M+NH4]+ 359.18662 192.3
[M+K]+ 380.11596 191.4
[M-H]- 340.14552 191.3
[M+Na-2H]- 362.12747 195.5
[M]+ 341.15225 188.7
[M]- 341.15335 188.7
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