CID 357145

Nsc615043

Structural Information

Molecular Formula
C18H14N2O2
SMILES
CN1C(=O)C2=C(C1(C3=CC=CC=C3)O)C4=CC=CC=C4N=C2
InChI
InChI=1S/C18H14N2O2/c1-20-17(21)14-11-19-15-10-6-5-9-13(15)16(14)18(20,22)12-7-3-2-4-8-12/h2-11,22H,1H3
InChIKey
VEHBSNJWIPGZEZ-UHFFFAOYSA-N
Compound name
1-hydroxy-2-methyl-1-phenylpyrrolo[3,4-c]quinolin-3-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

290.10553 Da
Monoisotopic Mass

2.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 291.112806 167.6
[M+Na]+ 313.094748 178.6
[M-H]- 289.098254 173.1
[M+NH4]+ 308.139353 185.7
[M+K]+ 329.068688 172.1
[M+H-H2O]+ 273.102790 158.7
[M+HCOO]- 335.103731 185.8
[M+CH3COO]- 349.119381 179.4
[M+Na-2H]- 311.080196 173.1
[M]+ 290.10498142 168.1
[M]- 290.10607858 168.1
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.