| SpectraBase Spectrum ID |
CWIHyhNRULs |
| Name |
Spiro[7H-benz[e]indene-7,2'-[1,3]dioxolane], 6-(2-butynyl)dodecahydro-3a,6-dimethyl-3-(2-methyl-1,3-dioxolan-2-yl) -, [3S-(3.alpha.,3a.alpha.,5a.beta.,6.beta.,9a.alpha.,9b.beta.)]- |
| Alternate Name(s) |
(1'S,2'S,5'S,6'S,9'S,10'R)-10'-(but-2-yn-1-yl)-6',10'-dimethyl-5'-(2-methyl-1,3-dioxolan-2-yl)spiro[1,3-dioxolane-2,11'-tricyclo[7.4.0.0(2,6)]tridecane]
5,5:20,20-bis(ethylenedioxy)-4,5-secopregn-2-yne |
| CAS Registry Number |
81917-18-2 |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C25H38O4 |
| InChI |
InChI=1S/C25H38O4/c1-5-6-11-23(3)20-10-12-22(2)19(7-8-21(22)24(4)26-14-15-27-24)18(20)9-13-25(23)28-16-17-29-25/h18-21H,7-17H2,1-4H3/t18-,19-,20-,21-,22-,23+/m0/s1 |
| InChIKey |
SUHBXASHQRENBU-RCTKEMKKSA-N |
| Molecular Weight |
402.575 g/mol |
| SMILES |
[C@@]12([C@]([C@@]3(CCC4([C@@]([C@]3(CC2)[H])(CC#CC)C)OCCO4)[H])(CC[C@@]1(C1(OCCO1)C)[H])[H])C |
| SPLASH |
splash10-0002-9000000000-853e96d11f1fff0a2131 |
| Source of Spectrum |
KC-1982-515-0 |
| Wiley ID |
1370561 |
![Spiro[7H-benz[e]indene-7,2'-[1,3]dioxolane], 6-(2-butynyl)dodecahydro-3a,6-dimethyl-3-(2-methyl-1,3-dioxolan-2-yl) -, [3S-(3.alpha.,3a.alpha.,5a.beta.,6.beta.,9a.alpha.,9b.beta.)]-](/api/spectrum/CWIHyhNRULs/structure.png?h=300&w=458 "Spiro[7H-benz[e]indene-7,2'-[1,3]dioxolane], 6-(2-butynyl)dodecahydro-3a,6-dimethyl-3-(2-methyl-1,3-dioxolan-2-yl) -, [3S-(3.alpha.,3a.alpha.,5a.beta.,6.beta.,9a.alpha.,9b.beta.)]-")
