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]+ 144.076746 128.1
[M+Na]+ 166.058688 136.5
[M-H]- 142.062194 128.4
[M+NH4]+ 161.103293 146.3
[M+K]+ 182.032628 136.6
[M+H-H2O]+ 126.066730 121.3
[M+HCOO]- 188.067671 149.5
[M+CH3COO]- 202.083321 172.3
[M+Na-2H]- 164.044136 133.7
[M]+ 143.06892142 127.8
[M]- 143.07001858 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.