CID 155970601

Methyl 1,2,3,5,8,8a-hexahydroindolizine-8a-carboxylate

Structural Information

Molecular Formula
C10H15NO2
SMILES
COC(=O)C12CCCN1CC=CC2
InChI
InChI=1S/C10H15NO2/c1-13-9(12)10-5-2-3-7-11(10)8-4-6-10/h2-3H,4-8H2,1H3
InChIKey
KUDJTZGRENUJBZ-UHFFFAOYSA-N
Compound name
methyl 2,3,5,8-tetrahydro-1H-indolizine-8a-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

181.11028 Da
Monoisotopic Mass

1.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 182.11756 140.8
[M+Na]+ 204.09950 147.0
[M-H]- 180.10300 143.2
[M+NH4]+ 199.14410 163.8
[M+K]+ 220.07344 145.8
[M+H-H2O]+ 164.10754 134.8
[M+HCOO]- 226.10848 159.6
[M+CH3COO]- 240.12413 178.3
[M+Na-2H]- 202.08495 145.8
[M]+ 181.10973 138.4
[M]- 181.11083 138.4
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.