CID 61312305

2-[(3-ethyl-1,2,4-oxadiazol-5-yl)methoxy]acetic acid

Structural Information

Molecular Formula
C7H10N2O4
SMILES
CCC1=NOC(=N1)COCC(=O)O
InChI
InChI=1S/C7H10N2O4/c1-2-5-8-6(13-9-5)3-12-4-7(10)11/h2-4H2,1H3,(H,10,11)
InChIKey
MXROHXRNFGPUBI-UHFFFAOYSA-N
Compound name
2-[(3-ethyl-1,2,4-oxadiazol-5-yl)methoxy]acetic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

186.06406 Da
Monoisotopic Mass

0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 187.07134 138.2
[M+Na]+ 209.05328 148.0
[M+NH4]+ 204.09788 143.5
[M+K]+ 225.02722 146.9
[M-H]- 185.05678 137.2
[M+Na-2H]- 207.03873 140.8
[M]+ 186.06351 138.8
[M]- 186.06461 138.8
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.