CID 138039595

Methyl 8-methoxy-7-azaspiro[3.5]non-7-ene-5-carboxylate

Structural Information

Molecular Formula
C11H17NO3
SMILES
COC1=NCC(C2(C1)CCC2)C(=O)OC
InChI
InChI=1S/C11H17NO3/c1-14-9-6-11(4-3-5-11)8(7-12-9)10(13)15-2/h8H,3-7H2,1-2H3
InChIKey
OQTGUCZHZHVWJU-UHFFFAOYSA-N
Compound name
methyl 6-methoxy-7-azaspiro[3.5]non-6-ene-9-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

211.12085 Da
Monoisotopic Mass

1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 212.12813 144.4
[M+Na]+ 234.11007 149.7
[M-H]- 210.11357 148.4
[M+NH4]+ 229.15467 157.8
[M+K]+ 250.08401 152.2
[M+H-H2O]+ 194.11811 133.4
[M+HCOO]- 256.11905 162.3
[M+CH3COO]- 270.13470 187.9
[M+Na-2H]- 232.09552 149.1
[M]+ 211.12030 152.7
[M]- 211.12140 152.7
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.