CID 487740

N-(4-dimethylaminophenyl)-2-hydroxy-5-nitro-benzamide

Structural Information

Molecular Formula
C15H15N3O4
SMILES
CN(C)C1=CC=C(C=C1)NC(=O)C2=C(C=CC(=C2)[N+](=O)[O-])O
InChI
InChI=1S/C15H15N3O4/c1-17(2)11-5-3-10(4-6-11)16-15(20)13-9-12(18(21)22)7-8-14(13)19/h3-9,19H,1-2H3,(H,16,20)
InChIKey
GGTCZKFEGVXJFF-UHFFFAOYSA-N
Compound name
N-[4-(dimethylamino)phenyl]-2-hydroxy-5-nitrobenzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

301.10626 Da
Monoisotopic Mass

3.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 302.11354 165.4
[M+Na]+ 324.09548 170.3
[M-H]- 300.09898 172.4
[M+NH4]+ 319.14008 178.6
[M+K]+ 340.06942 164.3
[M+H-H2O]+ 284.10352 161.6
[M+HCOO]- 346.10446 191.0
[M+CH3COO]- 360.12011 203.8
[M+Na-2H]- 322.08093 170.6
[M]+ 301.10571 164.1
[M]- 301.10681 164.1
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

No patent data available for this compound.