| SpectraBase Spectrum ID |
EcJJoupQjUh |
| Name |
2,11-Dioxatricyclo[13.2.2.13,7]eicosa-3,5,7(20),15,17,18-hexaen-10-one, 13-chloro-4-hydroxy-, (R)- |
| Alternate Name(s) |
(13R)-13-chloro-4-hydroxy-2,11-dioxatricyclo[13.2.2.1(3,7)]icosa-1(17),3(20),4,6,15,18-hexaen-10-one
3-Chloro-3,4-deoxycombretastain D-1 |
| CAS Registry Number |
126191-26-2 |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C18H17ClO4 |
| InChI |
InChI=1S/C18H17ClO4/c19-14-9-12-1-5-15(6-2-12)23-17-10-13(3-7-16(17)20)4-8-18(21)22-11-14/h1-3,5-7,10,14,20H,4,8-9,11H2/t14-/m1/s1 |
| InChIKey |
CCOHNDJPIFIAQT-CQSZACIVSA-N |
| Molecular Weight |
332.783 g/mol |
| SMILES |
Oc1c2Oc3ccc(cc3)C[C@@](Cl)(COC(CCc(c2)cc1)=O)[H] |
| SPLASH |
splash10-001i-0019000000-22078cb176235967e24d |
| Source of Spectrum |
J-55-2799-5 |
| Wiley ID |
1329312 |
![2,11-Dioxatricyclo[13.2.2.13,7]eicosa-3,5,7(20),15,17,18-hexaen-10-one, 13-chloro-4-hydroxy-, (R)-](/api/spectrum/EcJJoupQjUh/structure.png?h=300&w=458 "2,11-Dioxatricyclo[13.2.2.13,7]eicosa-3,5,7(20),15,17,18-hexaen-10-one, 13-chloro-4-hydroxy-, (R)-")
