CID 140236417

3-(3-methyloxetan-3-yl)-1,2-oxazol-5-amine

Structural Information

Molecular Formula
C7H10N2O2
SMILES
CC1(COC1)C2=NOC(=C2)N
InChI
InChI=1S/C7H10N2O2/c1-7(3-10-4-7)5-2-6(8)11-9-5/h2H,3-4,8H2,1H3
InChIKey
YBAXXLHEOQAQSR-UHFFFAOYSA-N
Compound name
3-(3-methyloxetan-3-yl)-1,2-oxazol-5-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

12
Patents

154.07423 Da
Monoisotopic Mass

0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 155.081506 124.7
[M+Na]+ 177.063448 131.7
[M-H]- 153.066954 131.3
[M+NH4]+ 172.108053 138.5
[M+K]+ 193.037388 135.9
[M+H-H2O]+ 137.071490 114.5
[M+HCOO]- 199.072431 146.4
[M+CH3COO]- 213.088081 178.6
[M+Na-2H]- 175.048896 132.7
[M]+ 154.07368142 133.8
[M]- 154.07477858 133.8
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

patents stripe