CID 24209012

2-(2-methoxy-4-methylphenoxy)-n-(2-nitrophenyl)acetamide

Structural Information

Molecular Formula
C16H16N2O5
SMILES
CC1=CC(=C(C=C1)OCC(=O)NC2=CC=CC=C2[N+](=O)[O-])OC
InChI
InChI=1S/C16H16N2O5/c1-11-7-8-14(15(9-11)22-2)23-10-16(19)17-12-5-3-4-6-13(12)18(20)21/h3-9H,10H2,1-2H3,(H,17,19)
InChIKey
GHECALHGODIDSS-UHFFFAOYSA-N
Compound name
2-(2-methoxy-4-methylphenoxy)-N-(2-nitrophenyl)acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

316.10593 Da
Monoisotopic Mass

3.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 317.11321 170.6
[M+Na]+ 339.09515 183.7
[M+NH4]+ 334.13975 177.0
[M+K]+ 355.06909 180.3
[M-H]- 315.09865 175.5
[M+Na-2H]- 337.08060 177.7
[M]+ 316.10538 173.6
[M]- 316.10648 173.6
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.