CID 264510

2'-methoxy-5'-nitroformanilide

Structural Information

Molecular Formula
C8H8N2O4
SMILES
COC1=C(C=C(C=C1)[N+](=O)[O-])NC=O
InChI
InChI=1S/C8H8N2O4/c1-14-8-3-2-6(10(12)13)4-7(8)9-5-11/h2-5H,1H3,(H,9,11)
InChIKey
WMFURCICLSTGEJ-UHFFFAOYSA-N
Compound name
N-(2-methoxy-5-nitrophenyl)formamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

63
Patents

196.0484 Da
Monoisotopic Mass

1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 197.055676 136.4
[M+Na]+ 219.037618 144.0
[M-H]- 195.041124 140.6
[M+NH4]+ 214.082223 154.7
[M+K]+ 235.011558 138.9
[M+H-H2O]+ 179.045660 134.7
[M+HCOO]- 241.046601 164.0
[M+CH3COO]- 255.062251 179.7
[M+Na-2H]- 217.023066 145.1
[M]+ 196.04785142 136.9
[M]- 196.04894858 136.9
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