CID 66166906

2-amino-1-(3-methyl-1,2,4-oxadiazol-5-yl)ethan-1-ol hydrochloride

Structural Information

Molecular Formula
C5H9N3O2
SMILES
CC1=NOC(=N1)C(CN)O
InChI
InChI=1S/C5H9N3O2/c1-3-7-5(10-8-3)4(9)2-6/h4,9H,2,6H2,1H3
InChIKey
OLKNCKXZKBJAHV-UHFFFAOYSA-N
Compound name
2-amino-1-(3-methyl-1,2,4-oxadiazol-5-yl)ethanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

143.06947 Da
Monoisotopic Mass

-1.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 144.07675 128.1
[M+Na]+ 166.05869 136.5
[M-H]- 142.06219 128.4
[M+NH4]+ 161.10329 146.3
[M+K]+ 182.03263 136.6
[M+H-H2O]+ 126.06673 121.3
[M+HCOO]- 188.06767 149.5
[M+CH3COO]- 202.08332 172.3
[M+Na-2H]- 164.04414 133.7
[M]+ 143.06892 127.8
[M]- 143.07002 127.8
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.