| SpectraBase Spectrum ID |
KhgGjDqALYH |
| Name |
[1S,3aS,4S,7aS]-(+)-1-tert-Butoxy-4-(2'-phenylethyl)-7a-methyl-3a,4,7,7a-tetrahydro-5(6)-indan-5-one |
| Alternate Name(s) |
(17beta)-17-tert-butoxy-9,10-secoestra-1,3,5(10)-trien-9-one |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C22H32O2 |
| InChI |
InChI=1S/C22H32O2/c1-21(2,3)24-20-13-12-18-17(19(23)14-15-22(18,20)4)11-10-16-8-6-5-7-9-16/h5-9,17-18,20H,10-15H2,1-4H3/t17-,18-,20-,22-/m0/s1 |
| InChIKey |
DBORIRMKDRPAJX-JEEBJRHZSA-N |
| Molecular Weight |
328.496 g/mol |
| SMILES |
[C@]12([C@]([C@](CCc3ccccc3)(C(CC1)=O)[H])(CC[C@@]2(OC(C)(C)C)[H])[H])C |
| SPLASH |
splash10-0api-5900000000-4df6dcb91065522d0c3c |
| Source of Spectrum |
F-47-7590-10 |
| Wiley ID |
1326810 |
![[1S,3aS,4S,7aS]-(+)-1-tert-Butoxy-4-(2'-phenylethyl)-7a-methyl-3a,4,7,7a-tetrahydro-5(6)-indan-5-one](/api/spectrum/KhgGjDqALYH/structure.png?h=300&w=458 "[1S,3aS,4S,7aS]-(+)-1-tert-Butoxy-4-(2'-phenylethyl)-7a-methyl-3a,4,7,7a-tetrahydro-5(6)-indan-5-one")
