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]+ 139.086596 121.9
[M+Na]+ 161.068538 128.9
[M-H]- 137.072044 125.3
[M+NH4]+ 156.113143 134.4
[M+K]+ 177.042478 131.1
[M+H-H2O]+ 121.076580 110.5
[M+HCOO]- 183.077521 141.4
[M+CH3COO]- 197.093171 173.1
[M+Na-2H]- 159.053986 128.2
[M]+ 138.07877142 129.2
[M]- 138.07986858 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.