CID 656880

156605-24-2

Structural Information

Molecular Formula
C11H10O5
SMILES
C1=CC(=CC2=C1C=CC(O2)(C(=O)O)O)CO
InChI
InChI=1S/C11H10O5/c12-6-7-1-2-8-3-4-11(15,10(13)14)16-9(8)5-7/h1-5,12,15H,6H2,(H,13,14)
InChIKey
RAPNWMUVBAAVEA-UHFFFAOYSA-N
Compound name
2-hydroxy-7-(hydroxymethyl)chromene-2-carboxylic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

3
Patents

222.05283 Da
Monoisotopic Mass

0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 223.06011 144.3
[M+Na]+ 245.04205 152.6
[M-H]- 221.04555 146.1
[M+NH4]+ 240.08665 162.3
[M+K]+ 261.01599 151.1
[M+H-H2O]+ 205.05009 139.4
[M+HCOO]- 267.05103 161.4
[M+CH3COO]- 281.06668 180.3
[M+Na-2H]- 243.02750 152.0
[M]+ 222.05228 144.6
[M]- 222.05338 144.6
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.