CID 92692

57166-83-3

Structural Information

Molecular Formula
C12H24N2O
SMILES
CCCCN(CCCC)CNC(=O)C=C
InChI
InChI=1S/C12H24N2O/c1-4-7-9-14(10-8-5-2)11-13-12(15)6-3/h6H,3-5,7-11H2,1-2H3,(H,13,15)
InChIKey
ZLVXBBQUJFPPNR-UHFFFAOYSA-N
Compound name
N-[(dibutylamino)methyl]prop-2-enamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

26
Patents

212.18886 Da
Monoisotopic Mass

2.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 213.196136 155.6
[M+Na]+ 235.178078 159.2
[M-H]- 211.181584 156.3
[M+NH4]+ 230.222683 174.4
[M+K]+ 251.152018 158.4
[M+H-H2O]+ 195.186120 149.0
[M+HCOO]- 257.187061 179.6
[M+CH3COO]- 271.202711 198.9
[M+Na-2H]- 233.163526 157.8
[M]+ 212.18831142 158.1
[M]- 212.18940858 158.1
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe