CID 3018739

77771-22-3

Structural Information

Molecular Formula
C15H14N2O2
SMILES
C1CC2=C(C(=CC=C2)O)N(C1)C(=O)C3=CN=CC=C3
InChI
InChI=1S/C15H14N2O2/c18-13-7-1-4-11-6-3-9-17(14(11)13)15(19)12-5-2-8-16-10-12/h1-2,4-5,7-8,10,18H,3,6,9H2
InChIKey
GUQABSUKMJPZHH-UHFFFAOYSA-N
Compound name
(8-hydroxy-3,4-dihydro-2H-quinolin-1-yl)-pyridin-3-ylmethanone
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

12
Patents

254.10553 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 255.112806 157.4
[M+Na]+ 277.094748 164.3
[M-H]- 253.098254 160.5
[M+NH4]+ 272.139353 171.5
[M+K]+ 293.068688 159.5
[M+H-H2O]+ 237.102790 148.3
[M+HCOO]- 299.103731 173.7
[M+CH3COO]- 313.119381 167.9
[M+Na-2H]- 275.080196 163.1
[M]+ 254.10498142 154.0
[M]- 254.10607858 154.0
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