CID 92271

N-methyl-n-nitroso-2-propanamine

Structural Information

Molecular Formula

C₄H₁₀N₂O

SMILES

CC(C)N(C)N=O

InChI

InChI=1S/C4H10N2O/c1-4(2)6(3)5-7/h4H,1-3H3

InChIKey

KQDYNYCCEGQPTN-UHFFFAOYSA-N

Compound name

N-methyl-N-propan-2-ylnitrous amide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 9
Patents: 102.079315 Da
Monoisotopic Mass: 1.0
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]+	103.08659	119.0
[M+Na]+	125.06853	126.0
[M-H]-	101.07204	122.6
[M+NH4]+	120.11314	143.0
[M+K]+	141.04247	128.9
[M+H-H2O]+	85.076575	113.7
[M+HCOO]-	147.07752	146.9
[M+CH3COO]-	161.09317	178.9
[M+Na-2H]-	123.05398	126.1
[M]+	102.07877	121.2
[M]-	102.07986	121.2

Literature stripe

literature stripe

Patent stripe

patents stripe