CID 152664

N-(2-aminoethyl)acrylamide hydrochloride

Structural Information

Molecular Formula
C5H10N2O
SMILES
C=CC(=O)NCCN
InChI
InChI=1S/C5H10N2O/c1-2-5(8)7-4-3-6/h2H,1,3-4,6H2,(H,7,8)
InChIKey
HXJGFDIZSMWOGY-UHFFFAOYSA-N
Compound name
N-(2-aminoethyl)prop-2-enamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

1982
Patents

114.079315 Da
Monoisotopic Mass

-0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 115.086591 123.6
[M+Na]+ 137.068533 129.9
[M-H]- 113.072039 123.6
[M+NH4]+ 132.113138 145.4
[M+K]+ 153.042473 129.2
[M+H-H2O]+ 97.076575 118.6
[M+HCOO]- 159.077516 148.8
[M+CH3COO]- 173.093166 173.4
[M+Na-2H]- 135.053981 129.2
[M]+ 114.07876642 121.1
[M]- 114.07986358 121.1
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