CID 11694089

(2e)-3-(4-chlorophenyl)-n-hydroxyacrylamide

Structural Information

Molecular Formula
C9H8ClNO2
SMILES
C1=CC(=CC=C1/C=C/C(=O)NO)Cl
InChI
InChI=1S/C9H8ClNO2/c10-8-4-1-7(2-5-8)3-6-9(12)11-13/h1-6,13H,(H,11,12)/b6-3+
InChIKey
YPYUWBDOEMPXSK-ZZXKWVIFSA-N
Compound name
(E)-3-(4-chlorophenyl)-N-hydroxyprop-2-enamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

4
References

4
Patents

197.02435 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 198.031626 139.0
[M+Na]+ 220.013568 147.3
[M-H]- 196.017074 141.5
[M+NH4]+ 215.058173 158.4
[M+K]+ 235.987508 142.7
[M+H-H2O]+ 180.021610 134.4
[M+HCOO]- 242.022551 158.5
[M+CH3COO]- 256.038201 180.3
[M+Na-2H]- 217.999016 144.6
[M]+ 197.02380142 139.4
[M]- 197.02489858 139.4
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