CID 46737147

1185303-98-3

Structural Information

Molecular Formula
C6H9N3O
SMILES
CC1=NOC(=N1)C2CNC2
InChI
InChI=1S/C6H9N3O/c1-4-8-6(10-9-4)5-2-7-3-5/h5,7H,2-3H2,1H3
InChIKey
YJUTYBZBQLBFJO-UHFFFAOYSA-N
Compound name
5-(azetidin-3-yl)-3-methyl-1,2,4-oxadiazole
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

5
Patents

139.07455 Da
Monoisotopic Mass

0.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 140.08183 124.2
[M+Na]+ 162.06377 131.4
[M+NH4]+ 157.10837 127.7
[M+K]+ 178.03771 130.9
[M-H]- 138.06727 123.2
[M+Na-2H]- 160.04922 127.5
[M]+ 139.07400 123.5
[M]- 139.07510 123.5
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

patents stripe