| SpectraBase Compound ID | 9MmmF8G3zaG |
|---|---|
| InChI | InChI=1S/C19H28O4/c1-11(20)22-10-15-14-9-18(3,4)7-13(14)8-19(5)16(15)6-17(19)23-12(2)21/h13,16-17H,6-10H2,1-5H3/t13-,16+,17-,19-/m0/s1 |
| InChIKey | LIMLVJCNCHQDLG-CZANMRCUSA-N |
| Mol Weight | 320.43 g/mol |
| Molecular Formula | C19H28O4 |
| Exact Mass | 320.198759 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 7htxw78vcTn |
|---|---|
| Name | 5,12-diacetoxysterpyrene |
| Alternate Name(s) | (1S,2aR,6aS,7aS)-3-acetoxymethyl-5,5,7a-trimethyl-2,2a,4,5,6,6a,7,7a-octahydro-1H-cyclobuta[f]inden-1-yl-acetic acid 3-(acetoxymethyl)-5,5,7a-trimethyl-2,2a,4,5,6,6a,7,7a-octahydro-1H-cyclobuta[f]inden-1-yl-acetic acid |
| CAS Registry Number | 138835-53-7 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C19H28O4 |
| InChI | InChI=1S/C19H28O4/c1-11(20)22-10-15-14-9-18(3,4)7-13(14)8-19(5)16(15)6-17(19)23-12(2)21/h13,16-17H,6-10H2,1-5H3/t13-,16+,17-,19-/m0/s1 |
| InChIKey | LIMLVJCNCHQDLG-CZANMRCUSA-N |
| Molecular Weight | 320.429 g/mol |
| SMILES | [C@@]12([C@](C(COC(=O)C)=C3[C@](C2)(CC(C)(C)C3)[H])([H])C[C@@]1(OC(=O)C)[H])C |
| SPLASH | splash10-05fr-1920000000-492b6086f80819f5780b |
| Source of Spectrum | J-57-2316-4 |
| Wiley ID | 1320293 |