CID 43559381

2-(5-ethyl-1,2,4-oxadiazol-3-yl)propan-2-amine hydrochloride

Structural Information

Molecular Formula
C7H13N3O
SMILES
CCC1=NC(=NO1)C(C)(C)N
InChI
InChI=1S/C7H13N3O/c1-4-5-9-6(10-11-5)7(2,3)8/h4,8H2,1-3H3
InChIKey
LENWSPLYWGKMCZ-UHFFFAOYSA-N
Compound name
2-(5-ethyl-1,2,4-oxadiazol-3-yl)propan-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

155.10587 Da
Monoisotopic Mass

0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 156.11315 133.8
[M+Na]+ 178.09509 142.5
[M-H]- 154.09859 135.3
[M+NH4]+ 173.13969 152.5
[M+K]+ 194.06903 142.5
[M+H-H2O]+ 138.10313 127.3
[M+HCOO]- 200.10407 155.2
[M+CH3COO]- 214.11972 178.3
[M+Na-2H]- 176.08054 140.7
[M]+ 155.10532 134.8
[M]- 155.10642 134.8
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.