CID 385094

Nsc676029

Structural Information

Molecular Formula
C17H11NO2
SMILES
CC1=C2C(=CC3=C1C(=O)C4=CC=CC=C4O3)C=CC=N2
InChI
InChI=1S/C17H11NO2/c1-10-15-14(9-11-5-4-8-18-16(10)11)20-13-7-3-2-6-12(13)17(15)19/h2-9H,1H3
InChIKey
VEVKSNNOFYPOBX-UHFFFAOYSA-N
Compound name
12-methylchromeno[2,3-g]quinolin-11-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

261.07898 Da
Monoisotopic Mass

3.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 262.08626 155.7
[M+Na]+ 284.06820 168.7
[M-H]- 260.07170 162.6
[M+NH4]+ 279.11280 173.2
[M+K]+ 300.04214 163.9
[M+H-H2O]+ 244.07624 147.0
[M+HCOO]- 306.07718 176.4
[M+CH3COO]- 320.09283 169.4
[M+Na-2H]- 282.05365 167.3
[M]+ 261.07843 160.5
[M]- 261.07953 160.5
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.