| SpectraBase Compound ID | HJnPxMs1PJH |
|---|---|
| InChI | InChI=1S/C11H17NO3/c1-15-11(14)8-4-3-7-12-9(8)5-2-6-10(12)13/h8-9H,2-7H2,1H3/t8-,9-/m0/s1 |
| InChIKey | RPCGMNNYJAFAML-IUCAKERBSA-N |
| Mol Weight | 211.26 g/mol |
| Molecular Formula | C11H17NO3 |
| Exact Mass | 211.120843 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | AzyxeVoO7vM |
|---|---|
| Name | (1S,9aS)-6-ketoquinolizidine-1-carboxylic acid methyl ester |
| Alternate Name(s) | (1S,9aS)-6-oxo-1,2,3,4,7,8,9,9a-octahydroquinolizine-1-carboxylic acid methyl ester Methyl (1S,9aS)-6-oxidanylidene-1,2,3,4,7,8,9,9a-octahydroquinolizine-1-carboxylate Methyl (1S,9aS)-6-oxo-1,2,3,4,7,8,9,9a-octahydroquinolizine-1-carboxylate |
| CAS Registry Number | 85588-63-2 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C11H17NO3 |
| InChI | InChI=1S/C11H17NO3/c1-15-11(14)8-4-3-7-12-9(8)5-2-6-10(12)13/h8-9H,2-7H2,1H3/t8-,9-/m0/s1 |
| InChIKey | RPCGMNNYJAFAML-IUCAKERBSA-N |
| Molecular Weight | 211.261 g/mol |
| SMILES | [C@@]12(N(CCC[C@@]2(C(=O)OC)[H])C(CCC1)=O)[H] |
| SPLASH | splash10-0a4j-4930000000-4e47d52628b129a33970 |
| Source of Spectrum | J-49-1686-0 |
| Wiley ID | 1210356 |