CID 24229781

916766-99-9

Structural Information

Molecular Formula
C11H11NO5
SMILES
C=CCOC(=O)NC1=CC(=CC(=C1)C(=O)O)O
InChI
InChI=1S/C11H11NO5/c1-2-3-17-11(16)12-8-4-7(10(14)15)5-9(13)6-8/h2,4-6,13H,1,3H2,(H,12,16)(H,14,15)
InChIKey
MYOCYAGTJQROGX-UHFFFAOYSA-N
Compound name
3-hydroxy-5-(prop-2-enoxycarbonylamino)benzoic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

237.06372 Da
Monoisotopic Mass

1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 238.07100 151.2
[M+Na]+ 260.05294 160.1
[M+NH4]+ 255.09754 155.8
[M+K]+ 276.02688 157.1
[M-H]- 236.05644 150.0
[M+Na-2H]- 258.03839 154.0
[M]+ 237.06317 151.5
[M]- 237.06427 151.5
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.