CID 25806

13256-12-7

Structural Information

Molecular Formula

C₄H₁₀N₄O₂

SMILES

CN(CCN(C)N=O)N=O

InChI

InChI=1S/C4H10N4O2/c1-7(5-9)3-4-8(2)6-10/h3-4H2,1-2H3

InChIKey

YHIARNFLMZPJGR-UHFFFAOYSA-N

Compound name

N-methyl-N-[2-[methyl(nitroso)amino]ethyl]nitrous amide

Related CIDs

2D Structure

compound 2d structure

2
Annotation Hits: 1
References: 3
Patents: 146.08037 Da
Monoisotopic Mass: 0.2
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]+	147.087646	127.2
[M+Na]+	169.069588	133.3
[M-H]-	145.073094	133.3
[M+NH4]+	164.114193	149.7
[M+K]+	185.043528	137.9
[M+H-H2O]+	129.077630	119.9
[M+HCOO]-	191.078571	160.3
[M+CH3COO]-	205.094221	195.4
[M+Na-2H]-	167.055036	135.6
[M]+	146.07982142	132.2
[M]-	146.08091858	132.2

Literature stripe

literature stripe

Patent stripe

patents stripe