CID 71434701

Nedrdwrrrotooa-uhfffaoysa-n

Structural Information

Molecular Formula
C6H14N2
SMILES
CC=CC(NC)NC
InChI
InChI=1S/C6H14N2/c1-4-5-6(7-2)8-3/h4-8H,1-3H3
InChIKey
NEDRDWRRROTOOA-UHFFFAOYSA-N
Compound name
1-N,1-N'-dimethylbut-2-ene-1,1-diamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

114.1157 Da
Monoisotopic Mass

0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 115.122976 126.5
[M+Na]+ 137.104918 132.1
[M-H]- 113.108424 126.8
[M+NH4]+ 132.149523 148.7
[M+K]+ 153.078858 131.7
[M+H-H2O]+ 97.112960 121.4
[M+HCOO]- 159.113901 151.4
[M+CH3COO]- 173.129551 176.0
[M+Na-2H]- 135.090366 132.6
[M]+ 114.11515142 124.6
[M]- 114.11624858 124.6
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.