CID 83833193

1552568-25-8

Structural Information

Molecular Formula
C10H10N2O3
SMILES
CN(C)C1=NC2=CC=CC(=C2O1)C(=O)O
InChI
InChI=1S/C10H10N2O3/c1-12(2)10-11-7-5-3-4-6(9(13)14)8(7)15-10/h3-5H,1-2H3,(H,13,14)
InChIKey
PHSCUPGANSHXNN-UHFFFAOYSA-N
Compound name
2-(dimethylamino)-1,3-benzoxazole-7-carboxylic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

206.06914 Da
Monoisotopic Mass

1.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 207.07642 141.2
[M+Na]+ 229.05836 153.4
[M+NH4]+ 224.10296 148.7
[M+K]+ 245.03230 151.2
[M-H]- 205.06186 143.7
[M+Na-2H]- 227.04381 146.3
[M]+ 206.06859 143.5
[M]- 206.06969 143.5
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.