CID 90407

24207-38-3

Structural Information

Molecular Formula
C9H11NO3
SMILES
C1=CC=C(C(=C1)C(=O)NCCO)O
InChI
InChI=1S/C9H11NO3/c11-6-5-10-9(13)7-3-1-2-4-8(7)12/h1-4,11-12H,5-6H2,(H,10,13)
InChIKey
NCPLWPQEVIBZKJ-UHFFFAOYSA-N
Compound name
2-hydroxy-N-(2-hydroxyethyl)benzamide
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

6
References

87
Patents

181.0739 Da
Monoisotopic Mass

0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 182.08118 138.1
[M+Na]+ 204.06312 148.3
[M+NH4]+ 199.10772 144.9
[M+K]+ 220.03706 143.7
[M-H]- 180.06662 138.7
[M+Na-2H]- 202.04857 143.2
[M]+ 181.07335 139.3
[M]- 181.07445 139.3
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