CID 15669520

Potassium 3-(furan-2-yl)-3-oxoprop-1-en-1-olate

Structural Information

Molecular Formula
C7H6O3
SMILES
C1=COC(=C1)C(=O)/C=C/O
InChI
InChI=1S/C7H6O3/c8-4-3-6(9)7-2-1-5-10-7/h1-5,8H/b4-3+
InChIKey
XGILJYGIMHVANM-ONEGZZNKSA-N
Compound name
(E)-1-(furan-2-yl)-3-hydroxyprop-2-en-1-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

138.0317 Da
Monoisotopic Mass

1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 139.03898 125.3
[M+Na]+ 161.02092 133.4
[M-H]- 137.02442 128.4
[M+NH4]+ 156.06552 146.6
[M+K]+ 176.99486 132.9
[M+H-H2O]+ 121.02896 120.6
[M+HCOO]- 183.02990 148.9
[M+CH3COO]- 197.04555 167.1
[M+Na-2H]- 159.00637 131.5
[M]+ 138.03115 126.0
[M]- 138.03225 126.0
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.