CID 373179

4-hydroxy-8-methyl-2-phenylquinoline

Structural Information

Molecular Formula
C16H13NO
SMILES
CC1=C2C(=CC=C1)C(=O)C=C(N2)C3=CC=CC=C3
InChI
InChI=1S/C16H13NO/c1-11-6-5-9-13-15(18)10-14(17-16(11)13)12-7-3-2-4-8-12/h2-10H,1H3,(H,17,18)
InChIKey
NGUWFPQUQMBYJN-UHFFFAOYSA-N
Compound name
8-methyl-2-phenyl-1H-quinolin-4-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

4
Patents

235.09972 Da
Monoisotopic Mass

3.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 236.10700 151.6
[M+Na]+ 258.08894 161.4
[M-H]- 234.09244 157.1
[M+NH4]+ 253.13354 168.5
[M+K]+ 274.06288 155.2
[M+H-H2O]+ 218.09698 143.6
[M+HCOO]- 280.09792 172.6
[M+CH3COO]- 294.11357 164.2
[M+Na-2H]- 256.07439 159.2
[M]+ 235.09917 150.6
[M]- 235.10027 150.6
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