CID 14269206

2-amino-1-cyclopropylethan-1-one hydrochloride

Structural Information

Molecular Formula
C5H9NO
SMILES
C1CC1C(=O)CN
InChI
InChI=1S/C5H9NO/c6-3-5(7)4-1-2-4/h4H,1-3,6H2
InChIKey
IVXXZDWPOACFBH-UHFFFAOYSA-N
Compound name
2-amino-1-cyclopropylethanone
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

63
Patents

99.06841 Da
Monoisotopic Mass

-0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 100.07569 118.0
[M+Na]+ 122.05763 126.8
[M-H]- 98.061134 122.4
[M+NH4]+ 117.10223 135.8
[M+K]+ 138.03157 125.2
[M+H-H2O]+ 82.065670 112.5
[M+HCOO]- 144.06661 142.3
[M+CH3COO]- 158.08226 172.3
[M+Na-2H]- 120.04308 124.3
[M]+ 99.067861 118.5
[M]- 99.068959 118.5
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