CID 71757676

3-(1,2,4-oxadiazol-3-yl)morpholine hydrochloride

Structural Information

Molecular Formula
C6H9N3O2
SMILES
C1COCC(N1)C2=NOC=N2
InChI
InChI=1S/C6H9N3O2/c1-2-10-3-5(7-1)6-8-4-11-9-6/h4-5,7H,1-3H2
InChIKey
UPVZMHVVZBKTBX-UHFFFAOYSA-N
Compound name
3-(1,2,4-oxadiazol-3-yl)morpholine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

155.06947 Da
Monoisotopic Mass

-0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 156.076746 130.1
[M+Na]+ 178.058688 136.6
[M-H]- 154.062194 131.9
[M+NH4]+ 173.103293 144.7
[M+K]+ 194.032628 137.1
[M+H-H2O]+ 138.066730 121.8
[M+HCOO]- 200.067671 146.5
[M+CH3COO]- 214.083321 142.2
[M+Na-2H]- 176.044136 137.2
[M]+ 155.06892142 126.5
[M]- 155.07001858 126.5
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.