CID 44486

N-methyl-n-nitrosobenzamide

Structural Information

Molecular Formula

C₈H₈N₂O₂

SMILES

CN(C(=O)C1=CC=CC=C1)N=O

InChI

InChI=1S/C8H8N2O2/c1-10(9-12)8(11)7-5-3-2-4-6-7/h2-6H,1H3

InChIKey

SLTNUKIKMOOUID-UHFFFAOYSA-N

Compound name

N-methyl-N-nitrosobenzamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 1
References: 11
Patents: 164.05858 Da
Monoisotopic Mass: 0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	165.06586	132.8
[M+Na]+	187.04780	144.0
[M+NH4]+	182.09240	141.0
[M+K]+	203.02174	138.8
[M-H]-	163.05130	135.9
[M+Na-2H]-	185.03325	140.5
[M]+	164.05803	135.0
[M]-	164.05913	135.0

Literature stripe

literature stripe

Patent stripe

patents stripe