CID 45489912

2230800-21-0

Structural Information

Molecular Formula
C8H10N2O3
SMILES
COC(=O)C1=NOC2=C1CCNC2
InChI
InChI=1S/C8H10N2O3/c1-12-8(11)7-5-2-3-9-4-6(5)13-10-7/h9H,2-4H2,1H3
InChIKey
WRKPTPZWVKYRRD-UHFFFAOYSA-N
Compound name
methyl 4,5,6,7-tetrahydro-[1,2]oxazolo[5,4-c]pyridine-3-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

182.06914 Da
Monoisotopic Mass

0.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 183.07642 136.6
[M+Na]+ 205.05836 144.2
[M-H]- 181.06186 137.5
[M+NH4]+ 200.10296 154.5
[M+K]+ 221.03230 143.6
[M+H-H2O]+ 165.06640 129.9
[M+HCOO]- 227.06734 154.0
[M+CH3COO]- 241.08299 175.8
[M+Na-2H]- 203.04381 142.2
[M]+ 182.06859 135.8
[M]- 182.06969 135.8
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

No patent data available for this compound.