CID 57145577

N3,n3-dimethylpyrrolidine-3,4-diamine trihydrochloride

Structural Information

Molecular Formula

C₆H₁₅N₃

SMILES

CN(C)C1CNCC1N

InChI

InChI=1S/C6H15N3/c1-9(2)6-4-8-3-5(6)7/h5-6,8H,3-4,7H2,1-2H3

InChIKey

UVCYEBCDODRTLL-UHFFFAOYSA-N

Compound name

3-N,3-N-dimethylpyrrolidine-3,4-diamine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 2
Patents: 129.1266 Da
Monoisotopic Mass: -1.2
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]+	130.13388	128.3
[M+Na]+	152.11582	135.9
[M+NH4]+	147.16042	136.4
[M+K]+	168.08976	133.5
[M-H]-	128.11932	129.7
[M+Na-2H]-	150.10127	132.0
[M]+	129.12605	129.3
[M]-	129.12715	129.3

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe