CID 12082972

182747-75-7

Structural Information

Molecular Formula
C10H8O4
SMILES
COC(=O)C1=CC2=C(O1)C=C(C=C2)O
InChI
InChI=1S/C10H8O4/c1-13-10(12)9-4-6-2-3-7(11)5-8(6)14-9/h2-5,11H,1H3
InChIKey
QWFLVOPCTQNVAN-UHFFFAOYSA-N
Compound name
methyl 6-hydroxy-1-benzofuran-2-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

48
Patents

192.04225 Da
Monoisotopic Mass

2.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 193.04953 135.1
[M+Na]+ 215.03147 145.9
[M-H]- 191.03497 140.3
[M+NH4]+ 210.07607 156.0
[M+K]+ 231.00541 145.0
[M+H-H2O]+ 175.03951 130.4
[M+HCOO]- 237.04045 159.1
[M+CH3COO]- 251.05610 178.7
[M+Na-2H]- 213.01692 142.5
[M]+ 192.04170 140.3
[M]- 192.04280 140.3
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