CID 724196

N-(3,5-dimethylphenyl)-2-oxo-2h-chromene-3-carboxamide

Structural Information

Molecular Formula
C18H15NO3
SMILES
CC1=CC(=CC(=C1)NC(=O)C2=CC3=CC=CC=C3OC2=O)C
InChI
InChI=1S/C18H15NO3/c1-11-7-12(2)9-14(8-11)19-17(20)15-10-13-5-3-4-6-16(13)22-18(15)21/h3-10H,1-2H3,(H,19,20)
InChIKey
VEEVYXMEZKHMDL-UHFFFAOYSA-N
Compound name
N-(3,5-dimethylphenyl)-2-oxochromene-3-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

293.1052 Da
Monoisotopic Mass

3.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 294.112476 166.6
[M+Na]+ 316.094418 175.9
[M-H]- 292.097924 175.7
[M+NH4]+ 311.139023 181.6
[M+K]+ 332.068358 172.7
[M+H-H2O]+ 276.102460 158.3
[M+HCOO]- 338.103401 189.4
[M+CH3COO]- 352.119051 206.5
[M+Na-2H]- 314.079866 172.7
[M]+ 293.10465142 169.5
[M]- 293.10574858 169.5
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.