CID 20750656

2-chloro-n-(2-hydroxy-5-nitrophenyl)acetamide

Structural Information

Molecular Formula
C8H7ClN2O4
SMILES
C1=CC(=C(C=C1[N+](=O)[O-])NC(=O)CCl)O
InChI
InChI=1S/C8H7ClN2O4/c9-4-8(13)10-6-3-5(11(14)15)1-2-7(6)12/h1-3,12H,4H2,(H,10,13)
InChIKey
OCOPCFMOIXUZCA-UHFFFAOYSA-N
Compound name
2-chloro-N-(2-hydroxy-5-nitrophenyl)acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

3
Patents

230.00943 Da
Monoisotopic Mass

1.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 231.016706 143.4
[M+Na]+ 252.998648 150.9
[M-H]- 229.002154 146.0
[M+NH4]+ 248.043253 160.5
[M+K]+ 268.972588 143.7
[M+H-H2O]+ 213.006690 143.3
[M+HCOO]- 275.007631 164.1
[M+CH3COO]- 289.023281 180.9
[M+Na-2H]- 250.984096 149.8
[M]+ 230.00888142 143.4
[M]- 230.00997858 143.4
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

patents stripe