CID 146842

23834-30-2

Structural Information

Molecular Formula

C₅H₁₃N₃O

SMILES

CN(C)CCN(C)N=O

InChI

InChI=1S/C5H13N3O/c1-7(2)4-5-8(3)6-9/h4-5H2,1-3H3

InChIKey

WDAHFRFQQRIZTK-UHFFFAOYSA-N

Compound name

N-[2-(dimethylamino)ethyl]-N-methylnitrous amide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 1
References: 0
Patents: 131.10587 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]+	132.113146	127.5
[M+Na]+	154.095088	133.5
[M-H]-	130.098594	132.2
[M+NH4]+	149.139693	150.5
[M+K]+	170.069028	137.0
[M+H-H2O]+	114.103130	121.1
[M+HCOO]-	176.104071	157.5
[M+CH3COO]-	190.119721	189.6
[M+Na-2H]-	152.080536	134.6
[M]+	131.10532142	131.1
[M]-	131.10641858	131.1

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.