| SpectraBase Spectrum ID |
ErOhokemQ0i |
| Name |
17.beta.-(t-Butoxy)-9.beta.-estra-1,3,5(10),6,11(12)-pentaene |
| Alternate Name(s) |
(-)-17.beta.-tert-Butyloxy-9.beta.-estra-1,3,5(10),6,11(12)-pentaene
(9beta,17beta)-17-tert-butoxyestra-1,3,5(10),6,11-pentaene |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C22H28O |
| InChI |
InChI=1S/C22H28O/c1-21(2,3)23-20-12-11-19-18-10-9-15-7-5-6-8-16(15)17(18)13-14-22(19,20)4/h5-10,13-14,17-20H,11-12H2,1-4H3/t17-,18+,19-,20-,22-/m0/s1 |
| InChIKey |
LZDDCSUAUYBASU-XCRACJGTSA-N |
| Molecular Weight |
308.465 g/mol |
| SMILES |
[C@@]12([C@]([C@@]3(C=Cc4c([C@@]3(C=C2)[H])cccc4)[H])(CC[C@@]1(OC(C)(C)C)[H])[H])C |
| SPLASH |
splash10-001i-1090000000-b6f88e96df9b10dbdaaf |
| Source of Spectrum |
C-120-8976-1a |
| Wiley ID |
1699849 |
