| SpectraBase Spectrum ID |
5LkHR2xap4V |
| Name |
(1S,3R,4S,5Z,8R)-3-Hydroxymethyl-2,9-dioxabicyclo[6.4.0]dodec-5-en-4-ol |
| Alternate Name(s) |
(4aS,6R,7S,10aR)-6-(hydroxymethyl)-2,3,4,4a,6,7,10,10a-octahydropyrano[3,2-b]oxocin-7-ol |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C11H18O4 |
| InChI |
InChI=1S/C11H18O4/c12-7-11-8(13)3-1-4-9-10(15-11)5-2-6-14-9/h1,3,8-13H,2,4-7H2/b3-1-/t8-,9+,10-,11+/m0/s1 |
| InChIKey |
RBAKSQQFDMDQOJ-GGHWLNFMSA-N |
| Molecular Weight |
214.261 g/mol |
| SMILES |
O[C@]1(\C=C/C[C@@]2([C@@](O[C@@]1(CO)[H])(CCCO2)[H])[H])[H] |
| SPLASH |
splash10-00di-9020000000-1ccebda60f7d2cb64c2e |
| Source of Spectrum |
KC-61-7404-35 |
| Wiley ID |
1629994 |
![(1S,3R,4S,5Z,8R)-3-Hydroxymethyl-2,9-dioxabicyclo[6.4.0]dodec-5-en-4-ol](/api/spectrum/5LkHR2xap4V/structure.png?h=300&w=458 "(1S,3R,4S,5Z,8R)-3-Hydroxymethyl-2,9-dioxabicyclo[6.4.0]dodec-5-en-4-ol")
