CID 338232

97126-20-0

Structural Information

Molecular Formula
C11H10N2O3
SMILES
CC(=O)NC1=CC2=C(C=CC(=C2)N)OC1=O
InChI
InChI=1S/C11H10N2O3/c1-6(14)13-9-5-7-4-8(12)2-3-10(7)16-11(9)15/h2-5H,12H2,1H3,(H,13,14)
InChIKey
LZDJQRLPKGUGHL-UHFFFAOYSA-N
Compound name
N-(6-amino-2-oxochromen-3-yl)acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

11
Patents

218.06914 Da
Monoisotopic Mass

0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 219.07642 144.4
[M+Na]+ 241.05836 153.8
[M-H]- 217.06186 150.2
[M+NH4]+ 236.10296 162.3
[M+K]+ 257.03230 152.2
[M+H-H2O]+ 201.06640 137.9
[M+HCOO]- 263.06734 168.7
[M+CH3COO]- 277.08299 192.7
[M+Na-2H]- 239.04381 152.0
[M]+ 218.06859 145.5
[M]- 218.06969 145.5
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

patents stripe