CID 90402361

1-(1,2,4-oxadiazol-3-yl)cyclopropan-1-amine hydrochloride

Structural Information

Molecular Formula
C5H7N3O
SMILES
C1CC1(C2=NOC=N2)N
InChI
InChI=1S/C5H7N3O/c6-5(1-2-5)4-7-3-9-8-4/h3H,1-2,6H2
InChIKey
IQLWFRCCOOXJRW-UHFFFAOYSA-N
Compound name
1-(1,2,4-oxadiazol-3-yl)cyclopropan-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

5
Patents

125.058914 Da
Monoisotopic Mass

-0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 126.06619 125.6
[M+Na]+ 148.04813 136.6
[M-H]- 124.05164 131.2
[M+NH4]+ 143.09274 142.0
[M+K]+ 164.02207 135.9
[M+H-H2O]+ 108.05617 118.9
[M+HCOO]- 170.05712 149.2
[M+CH3COO]- 184.07276 139.8
[M+Na-2H]- 146.03358 134.6
[M]+ 125.05837 127.6
[M]- 125.05946 127.6
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.