| SpectraBase Compound ID | Jdi1UDIYkkF |
|---|---|
| InChI | InChI=1S/C22H30O3/c1-13-24-12-15-11-20-19-6-4-14-10-16(23-3)5-7-17(14)18(19)8-9-22(20,2)21(15)25-13/h5,7,10,13,15,18-21H,4,6,8-9,11-12H2,1-3H3/t13-,15-,18?,19?,20?,21-,22+/m0/s1 |
| InChIKey | IDXSCPVEPDXESL-LYBANIJRSA-N |
| Mol Weight | 342.48 g/mol |
| Molecular Formula | C22H30O3 |
| Exact Mass | 342.219495 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | He6oFtK2Wcn |
|---|---|
| Name | 16.alpha.-(Hydroxymethyl)-3-methoxy-13.alpha.-estra-1,3,5(10)-trien-17.beta.-ol - Acetaldehyde-Acetal |
| Alternate Name(s) | (6aR,6bS,8S,10aS)-2-methoxy-6a,8-dimethyl-4b,5,6,6a,6b,10,10a,11,11a,11b,12,13-dodecahydronaphtho[2',1':4,5]indeno[1,2-d][1,3]dioxin (6aR,6bS,8S,10aS)-6a,8-dimethyl-4b,5,6,6a,6b,10,10a,11,11a,11b,12,13-dodecahydronaphtho[2',1':4,5]indeno[1,2-d][1,3]dioxin-2-yl methyl ether |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C22H30O3 |
| InChI | InChI=1S/C22H30O3/c1-13-24-12-15-11-20-19-6-4-14-10-16(23-3)5-7-17(14)18(19)8-9-22(20,2)21(15)25-13/h5,7,10,13,15,18-21H,4,6,8-9,11-12H2,1-3H3/t13-,15-,18?,19?,20?,21-,22+/m0/s1 |
| InChIKey | IDXSCPVEPDXESL-LYBANIJRSA-N |
| Molecular Weight | 342.479 g/mol |
| SMILES | [C@]12(C(C3CCc4c(C3CC2)ccc(OC)c4)C[C@@]2([C@@]1(O[C@](OC2)(C)[H])[H])[H])C |
| SPLASH | splash10-0006-0109000000-f6f925538fbb94be32d7 |
| Source of Spectrum | G-68-1148-6 |
| Wiley ID | 1520468 |