CID 132351172

2137451-00-2

Structural Information

Molecular Formula
C7H11NO3
SMILES
COC(=O)C12CC(CN1)OC2
InChI
InChI=1S/C7H11NO3/c1-10-6(9)7-2-5(3-8-7)11-4-7/h5,8H,2-4H2,1H3
InChIKey
RTMKITWWTCEMNZ-UHFFFAOYSA-N
Compound name
methyl 2-oxa-5-azabicyclo[2.2.1]heptane-4-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

157.0739 Da
Monoisotopic Mass

-0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 158.08118 132.3
[M+Na]+ 180.06312 139.5
[M-H]- 156.06662 133.0
[M+NH4]+ 175.10772 156.7
[M+K]+ 196.03706 139.7
[M+H-H2O]+ 140.07116 128.3
[M+HCOO]- 202.07210 150.3
[M+CH3COO]- 216.08775 170.5
[M+Na-2H]- 178.04857 138.0
[M]+ 157.07335 131.8
[M]- 157.07445 131.8
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.