CID 214637

Brn 1377146

Structural Information

Molecular Formula
C11H9NO4
SMILES
COC1=CC2=C(C=C1)C(=O)C=C(O2)C(=O)N
InChI
InChI=1S/C11H9NO4/c1-15-6-2-3-7-8(13)5-10(11(12)14)16-9(7)4-6/h2-5H,1H3,(H2,12,14)
InChIKey
VDPPPVMTEAHVLI-UHFFFAOYSA-N
Compound name
7-methoxy-4-oxochromene-2-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

7
Patents

219.05316 Da
Monoisotopic Mass

1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 220.06044 142.4
[M+Na]+ 242.04238 152.5
[M-H]- 218.04588 148.2
[M+NH4]+ 237.08698 160.4
[M+K]+ 258.01632 151.5
[M+H-H2O]+ 202.05042 136.1
[M+HCOO]- 264.05136 165.9
[M+CH3COO]- 278.06701 190.4
[M+Na-2H]- 240.02783 149.8
[M]+ 219.05261 145.7
[M]- 219.05371 145.7
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

patents stripe