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]+ 308.128126 171.3
[M+Na]+ 330.110068 178.9
[M-H]- 306.113574 179.9
[M+NH4]+ 325.154673 185.3
[M+K]+ 346.084008 176.0
[M+H-H2O]+ 290.118110 162.8
[M+HCOO]- 352.119051 192.7
[M+CH3COO]- 366.134701 209.1
[M+Na-2H]- 328.095516 176.4
[M]+ 307.12030142 173.4
[M]- 307.12139858 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.