CID 58595

N-(1-naphthyl)-2-nitroacetamide

Structural Information

Molecular Formula
C12H10N2O3
SMILES
C1=CC=C2C(=C1)C=CC=C2NC(=O)C[N+](=O)[O-]
InChI
InChI=1S/C12H10N2O3/c15-12(8-14(16)17)13-11-7-3-5-9-4-1-2-6-10(9)11/h1-7H,8H2,(H,13,15)
InChIKey
DQVOJTDRCCZEJJ-UHFFFAOYSA-N
Compound name
N-naphthalen-1-yl-2-nitroacetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

230.06914 Da
Monoisotopic Mass

2.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 231.07642 146.6
[M+Na]+ 253.05836 159.8
[M+NH4]+ 248.10296 155.0
[M+K]+ 269.03230 155.8
[M-H]- 229.06186 150.9
[M+Na-2H]- 251.04381 153.5
[M]+ 230.06859 149.5
[M]- 230.06969 149.5
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.