CID 40468294

6-acetyaminochroman-4-one

Structural Information

Molecular Formula
C11H11NO3
SMILES
CC(=O)NC1=CC2=C(C=C1)OCCC2=O
InChI
InChI=1S/C11H11NO3/c1-7(13)12-8-2-3-11-9(6-8)10(14)4-5-15-11/h2-3,6H,4-5H2,1H3,(H,12,13)
InChIKey
IASWWLNIFLMDBI-UHFFFAOYSA-N
Compound name
N-(4-oxo-2,3-dihydrochromen-6-yl)acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

3
Patents

205.0739 Da
Monoisotopic Mass

0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 206.08118 142.5
[M+Na]+ 228.06312 154.4
[M+NH4]+ 223.10772 150.6
[M+K]+ 244.03706 149.0
[M-H]- 204.06662 146.1
[M+Na-2H]- 226.04857 147.3
[M]+ 205.07335 145.0
[M]- 205.07445 145.0
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.