CID 724180

2-oxo-n-[2-(propan-2-yl)phenyl]-2h-chromene-3-carboxamide

Structural Information

Molecular Formula
C19H17NO3
SMILES
CC(C)C1=CC=CC=C1NC(=O)C2=CC3=CC=CC=C3OC2=O
InChI
InChI=1S/C19H17NO3/c1-12(2)14-8-4-5-9-16(14)20-18(21)15-11-13-7-3-6-10-17(13)23-19(15)22/h3-12H,1-2H3,(H,20,21)
InChIKey
UARDZXVQBMGAOJ-UHFFFAOYSA-N
Compound name
2-oxo-N-(2-propan-2-ylphenyl)chromene-3-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

2
References

0
Patents

307.12085 Da
Monoisotopic Mass

4.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 308.12813 171.3
[M+Na]+ 330.11007 178.9
[M-H]- 306.11357 179.9
[M+NH4]+ 325.15467 185.3
[M+K]+ 346.08401 176.0
[M+H-H2O]+ 290.11811 162.8
[M+HCOO]- 352.11905 192.7
[M+CH3COO]- 366.13470 209.1
[M+Na-2H]- 328.09552 176.4
[M]+ 307.12030 173.4
[M]- 307.12140 173.4
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.