CID 89217

19764-58-0

Structural Information

Molecular Formula

C₅H₁₄N₂

SMILES

CC(CN)N(C)C

InChI

InChI=1S/C5H14N2/c1-5(4-6)7(2)3/h5H,4,6H2,1-3H3

InChIKey

WNLWBCIUNCAMPH-UHFFFAOYSA-N

Compound name

2-N,2-N-dimethylpropane-1,2-diamine

Related CIDs

2D Structure

compound 2d structure

3
Annotation Hits: 0
References: 1320
Patents: 102.1157 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]+	103.122976	123.6
[M+Na]+	125.104918	129.4
[M-H]-	101.108424	125.0
[M+NH4]+	120.149523	146.6
[M+K]+	141.078858	130.9
[M+H-H2O]+	85.112960	118.4
[M+HCOO]-	147.113901	148.5
[M+CH3COO]-	161.129551	177.5
[M+Na-2H]-	123.090366	128.4
[M]+	102.11515142	122.3
[M]-	102.11624858	122.3

Literature stripe

literature stripe

Patent stripe

patents stripe