| SpectraBase Compound ID | KoAh7BbArPh |
|---|---|
| InChI | InChI=1S/C13H18O3/c1-2-16-13(15)10-7-3-5-9-6-4-8-11(14)12(9)10/h10H,2-8H2,1H3 |
| InChIKey | GTMUUSUHDHOGHY-UHFFFAOYSA-N |
| Mol Weight | 222.28 g/mol |
| Molecular Formula | C13H18O3 |
| Exact Mass | 222.125594 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | KOgMk8NIqfc |
|---|---|
| Name | 8-keto-2,3,4,5,6,7-hexahydro-1H-naphthalene-1-carboxylic acid ethyl ester |
| Alternate Name(s) | 8-Oxo-2,3,4,5,6,7-hexahydro-1H-naphthalene-1-carboxylic acid ethyl ester Ethyl 8-oxidanylidene-2,3,4,5,6,7-hexahydro-1H-naphthalene-1-carboxylate Ethyl 8-oxo-1,2,3,4,5,6,7,8-octahydro-1-naphthalenecarboxylate Ethyl 8-oxo-2,3,4,5,6,7-hexahydro-1H-naphthalene-1-carboxylate |
| CAS Registry Number | 112400-25-6 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C13H18O3 |
| InChI | InChI=1S/C13H18O3/c1-2-16-13(15)10-7-3-5-9-6-4-8-11(14)12(9)10/h10H,2-8H2,1H3 |
| InChIKey | GTMUUSUHDHOGHY-UHFFFAOYSA-N |
| Molecular Weight | 222.284 g/mol |
| SMILES | C1=2C(C(=O)OCC)CCCC2CCCC1=O |
| SPLASH | splash10-002b-0900000000-75c94d4b17c72da54c4b |
| Source of Spectrum | J-53-903-7 |
| Wiley ID | 1222601 |