![Methyl 1-chloro-3-oxo-4-phenyloctahydrocyclopenta[c]pyran-1-carboxylate](/api/spectrum/4q26ZW0e5A/structure.png?h=300&w=458 "Methyl 1-chloro-3-oxo-4-phenyloctahydrocyclopenta[c]pyran-1-carboxylate")
| SpectraBase Compound ID | 8A6KmCVjlnc |
|---|---|
| InChI | InChI=1S/C16H17ClO4/c1-20-15(19)16(17)12-9-5-8-11(12)13(14(18)21-16)10-6-3-2-4-7-10/h2-4,6-7,11-13H,5,8-9H2,1H3 |
| InChIKey | MFZGZHOLUBIIQQ-UHFFFAOYSA-N |
| Mol Weight | 308.76 g/mol |
| Molecular Formula | C16H17ClO4 |
| Exact Mass | 308.081537 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 4q26ZW0e5A |
|---|---|
| Name | Methyl 1-chloro-3-oxo-4-phenyloctahydrocyclopenta[c]pyran-1-carboxylate |
| CAS Registry Number | 140633-67-6 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C16H17ClO4 |
| InChI | InChI=1S/C16H17ClO4/c1-20-15(19)16(17)12-9-5-8-11(12)13(14(18)21-16)10-6-3-2-4-7-10/h2-4,6-7,11-13H,5,8-9H2,1H3 |
| InChIKey | MFZGZHOLUBIIQQ-UHFFFAOYSA-N |
| Molecular Weight | 308.761 g/mol |
| SMILES | COC(C1(C2CCCC2C(c2ccccc2)C(=O)O1)Cl)=O |
| SPLASH | splash10-05mo-6920000000-bec28cfc2292f6d0d08b |
| Source of Spectrum | K-125-1916-8 |
| Synonyms | 1-Chloro-3-keto-4-phenyl-4,4a,5,6,7,7a-hexahydrocyclopenta[c]pyran-1-carboxylic acid methyl ester 1-Chloro-3-oxo-4-phenyl-4,4a,5,6,7,7a-hexahydrocyclopenta[c]pyran-1-carboxylic acid methyl ester Cyclopenta[c]pyran-1-carboxylic acid, 1-chlorooctahydro-3-oxo-4-phenyl-, methyl ester, (4.alpha.,4a.beta.,7a.beta.)- Methyl 1-chloranyl-3-oxidanylidene-4-phenyl-4,4a,5,6,7,7a-hexahydrocyclopenta[c]pyran-1-carboxylate Methyl 1-chloro-3-oxo-4-phenyl-4,4a,5,6,7,7a-hexahydrocyclopenta[c]pyran-1-carboxylate |
| Wiley ID | 1309622 |