CID 137942464

2287287-82-3

Structural Information

Molecular Formula
C7H10N2O
SMILES
CC1=CON=C1C2CNC2
InChI
InChI=1S/C7H10N2O/c1-5-4-10-9-7(5)6-2-8-3-6/h4,6,8H,2-3H2,1H3
InChIKey
JHRBFWPQIQHQKJ-UHFFFAOYSA-N
Compound name
3-(azetidin-3-yl)-4-methyl-1,2-oxazole
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

138.07932 Da
Monoisotopic Mass

0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 139.08660 121.9
[M+Na]+ 161.06854 128.9
[M-H]- 137.07204 125.3
[M+NH4]+ 156.11314 134.4
[M+K]+ 177.04248 131.1
[M+H-H2O]+ 121.07658 110.5
[M+HCOO]- 183.07752 141.4
[M+CH3COO]- 197.09317 173.1
[M+Na-2H]- 159.05399 128.2
[M]+ 138.07877 129.2
[M]- 138.07987 129.2
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.