CID 18446443

1220029-74-2

Structural Information

Molecular Formula
C5H10N2O
SMILES
C=CCNC(=O)CN
InChI
InChI=1S/C5H10N2O/c1-2-3-7-5(8)4-6/h2H,1,3-4,6H2,(H,7,8)
InChIKey
JDQBJMHNGNZBIO-UHFFFAOYSA-N
Compound name
2-amino-N-prop-2-enylacetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

68
Patents

114.079315 Da
Monoisotopic Mass

-0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 115.08659 123.6
[M+Na]+ 137.06853 129.9
[M-H]- 113.07204 123.6
[M+NH4]+ 132.11314 145.4
[M+K]+ 153.04247 129.2
[M+H-H2O]+ 97.076575 118.6
[M+HCOO]- 159.07752 148.8
[M+CH3COO]- 173.09317 173.4
[M+Na-2H]- 135.05398 129.2
[M]+ 114.07877 121.1
[M]- 114.07986 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