CID 22661059

5-(methoxymethyl)-1,3,4-oxadiazol-2-amine

Structural Information

Molecular Formula
C4H7N3O2
SMILES
COCC1=NN=C(O1)N
InChI
InChI=1S/C4H7N3O2/c1-8-2-3-6-7-4(5)9-3/h2H2,1H3,(H2,5,7)
InChIKey
PCSCBXATDIODSV-UHFFFAOYSA-N
Compound name
5-(methoxymethyl)-1,3,4-oxadiazol-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

25
Patents

129.05383 Da
Monoisotopic Mass

-1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 130.06111 121.8
[M+Na]+ 152.04305 131.3
[M-H]- 128.04655 123.5
[M+NH4]+ 147.08765 141.4
[M+K]+ 168.01699 132.1
[M+H-H2O]+ 112.05109 115.0
[M+HCOO]- 174.05203 146.1
[M+CH3COO]- 188.06768 170.9
[M+Na-2H]- 150.02850 129.7
[M]+ 129.05328 123.7
[M]- 129.05438 123.7
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

patents stripe