CID 443193

2-hydroxy-2h-benzo[h]chromene-2-carboxylate

Structural Information

Molecular Formula
C14H10O4
SMILES
C1=CC=C2C(=C1)C=CC3=C2OC(C=C3)(C(=O)O)O
InChI
InChI=1S/C14H10O4/c15-13(16)14(17)8-7-10-6-5-9-3-1-2-4-11(9)12(10)18-14/h1-8,17H,(H,15,16)
InChIKey
JHPCFHVVWPKZJP-UHFFFAOYSA-N
Compound name
2-hydroxybenzo[h]chromene-2-carboxylic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

242.0579 Da
Monoisotopic Mass

2.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 243.06518 149.7
[M+Na]+ 265.04712 158.7
[M-H]- 241.05062 153.7
[M+NH4]+ 260.09172 168.5
[M+K]+ 281.02106 156.1
[M+H-H2O]+ 225.05516 143.7
[M+HCOO]- 287.05610 166.9
[M+CH3COO]- 301.07175 162.1
[M+Na-2H]- 263.03257 159.2
[M]+ 242.05735 150.1
[M]- 242.05845 150.1
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.