| SpectraBase Spectrum ID |
JvUjllTRXoi |
| Name |
1,4-Dioxaspiro[4.4]nonane-6-carboxaldehyde, 6-methyl-7-(1,2,3,4-tetrahydro-6-methoxy-1-oxo-2-naphthalenyl)-, [6R-[6.alpha.,7.beta.(S*)]]- |
| Alternate Name(s) |
(6R,7S)-7-[(2S)-6-methoxy-1-oxo-1,2,3,4-tetrahydro-2-naphthalenyl]-6-methyl-1,4-dioxaspiro[4.4]nonane-6-carbaldehyde
17,17-(ethylenedioxy)-3-methoxy-9-oxo-11-nor-9,11-seco-1,3,5(10)-estratrien-12-al |
| CAS Registry Number |
125285-36-1 |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C20H24O5 |
| InChI |
InChI=1S/C20H24O5/c1-19(12-21)17(7-8-20(19)24-9-10-25-20)16-5-3-13-11-14(23-2)4-6-15(13)18(16)22/h4,6,11-12,16-17H,3,5,7-10H2,1-2H3/t16-,17-,19-/m0/s1 |
| InChIKey |
XWDMUVGMDSAJQD-LNLFQRSKSA-N |
| Molecular Weight |
344.407 g/mol |
| SMILES |
[C@@]1(C2(OCCO2)CC[C@]1([C@]1(C(c2ccc(cc2CC1)OC)=O)[H])[H])(C=O)C |
| SPLASH |
splash10-004i-0900000000-6fb43868364f98b30ba9 |
| Source of Spectrum |
H-72-728-9 |
| Wiley ID |
1338007 |
![1,4-Dioxaspiro[4.4]nonane-6-carboxaldehyde, 6-methyl-7-(1,2,3,4-tetrahydro-6-methoxy-1-oxo-2-naphthalenyl)-, [6R-[6.alpha.,7.beta.(S*)]]-](/api/spectrum/JvUjllTRXoi/structure.png?h=300&w=458 "1,4-Dioxaspiro[4.4]nonane-6-carboxaldehyde, 6-methyl-7-(1,2,3,4-tetrahydro-6-methoxy-1-oxo-2-naphthalenyl)-, [6R-[6.alpha.,7.beta.(S*)]]-")
