CID 120242

Benzanilide, n-(2-morpholinoethyl)-4-nitro-, hydrochloride

Structural Information

Molecular Formula
C19H21N3O4
SMILES
C1COCCN1CCN(C2=CC=CC=C2)C(=O)C3=CC=C(C=C3)[N+](=O)[O-]
InChI
InChI=1S/C19H21N3O4/c23-19(16-6-8-18(9-7-16)22(24)25)21(17-4-2-1-3-5-17)11-10-20-12-14-26-15-13-20/h1-9H,10-15H2
InChIKey
YHAWVWSVUZGLDB-UHFFFAOYSA-N
Compound name
N-(2-morpholin-4-ylethyl)-4-nitro-N-phenylbenzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

355.1532 Da
Monoisotopic Mass

2.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 356.16048 182.9
[M+Na]+ 378.14242 183.4
[M-H]- 354.14592 191.4
[M+NH4]+ 373.18702 190.7
[M+K]+ 394.11636 178.0
[M+H-H2O]+ 338.15046 176.1
[M+HCOO]- 400.15140 202.2
[M+CH3COO]- 414.16705 211.2
[M+Na-2H]- 376.12787 187.9
[M]+ 355.15265 178.7
[M]- 355.15375 178.7
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.