CID 584

2-hydroxychromene-2-carboxylate

Structural Information

Molecular Formula
C10H8O4
SMILES
C1=CC=C2C(=C1)C=CC(O2)(C(=O)O)O
InChI
InChI=1S/C10H8O4/c11-9(12)10(13)6-5-7-3-1-2-4-8(7)14-10/h1-6,13H,(H,11,12)
InChIKey
LGYIZQLNYONEFJ-UHFFFAOYSA-N
Compound name
2-hydroxychromene-2-carboxylic acid
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

10
References

38
Patents

192.04225 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 193.04953 137.3
[M+Na]+ 215.03147 149.8
[M+NH4]+ 210.07607 146.7
[M+K]+ 231.00541 143.4
[M-H]- 191.03497 139.6
[M+Na-2H]- 213.01692 143.9
[M]+ 192.04170 139.8
[M]- 192.04280 139.8
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