![1H-Naphtho[2,1-b]pyran-7-carboxylic acid, 3-ethyldodecahydro-3,4a,7,10a-tetramethyl-, methyl ester, [3S-(3.alpha.,4a.beta.,6a.alpha.,7.beta.,10a.beta.,10b.alpha.)]-](/api/spectrum/E7LjHg2u39L/structure.png?h=300&w=458 "1H-Naphtho[2,1-b]pyran-7-carboxylic acid, 3-ethyldodecahydro-3,4a,7,10a-tetramethyl-, methyl ester, [3S-(3.alpha.,4a.beta.,6a.alpha.,7.beta.,10a.beta.,10b.alpha.)]-")
| SpectraBase Compound ID | 4RWijxi10FM |
|---|---|
| InChI | InChI=1S/C21H36O3/c1-7-18(2)13-9-16-19(3)11-8-12-20(4,17(22)23-6)15(19)10-14-21(16,5)24-18/h15-16H,7-14H2,1-6H3 |
| InChIKey | JAPBIVUKGRULCN-UHFFFAOYSA-N |
| Mol Weight | 336.5 g/mol |
| Molecular Formula | C21H36O3 |
| Exact Mass | 336.266445 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | E7LjHg2u39L |
|---|---|
| Name | 1H-Naphtho[2,1-b]pyran-7-carboxylic acid, 3-ethyldodecahydro-3,4a,7,10a-tetramethyl-, methyl ester, [3S-(3.alpha.,4a.beta.,6a.alpha.,7.beta.,10a.beta.,10b.alpha.)]- |
| CAS Registry Number | 56630-93-4 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C21H36O3 |
| InChI | InChI=1S/C21H36O3/c1-7-18(2)13-9-16-19(3)11-8-12-20(4,17(22)23-6)15(19)10-14-21(16,5)24-18/h15-16H,7-14H2,1-6H3 |
| InChIKey | JAPBIVUKGRULCN-UHFFFAOYSA-N |
| Molecular Weight | 336.516 g/mol |
| SMILES | CC12C3C(C)(CCC2C(C(OC)=O)(C)CCC1)OC(CC3)(CC)C |
| SPLASH | splash10-052f-9421000000-07039915d25183791c66 |
| Source of Spectrum | EP-5539-0-0 |
| Synonyms | Methyl 3-ethyl-3,4a,7,10a-tetramethyldodecahydro-1H-benzo[f]chromene-7-carboxylate 3-Ethyl-3,4a,7,10a-tetramethyl-2,5,6,6a,8,9,10,10b-octahydro-1H-benzo[f]chromene-7-carboxylic acid methyl ester 3-Ethyl-3,4a,7,10a-tetramethyl-2,5,6,6a,8,9,10,10b-octahydro-1H-benzo[f][1]benzopyran-7-carboxylic acid methyl ester Methyl 3-ethyl-3,4a,7,10a-tetramethyl-2,5,6,6a,8,9,10,10b-octahydro-1H-benzo[f]chromene-7-carboxylate |
| Wiley ID | 1332702 |