| SpectraBase Spectrum ID |
58uT8BkuTES |
| Name |
2-(2'-chloroprop-2'-enyl)-1,4-dihydroxy-3-(prop-2''-enyl)anthraquinone |
| Alternate Name(s) |
2-(2'-Chloroprop-2'-enyl)-1,4-dihydroxy-3-(prop-2''-enyl)anthraquinone
2-allyl-3-(2-chloro-2-propenyl)-1,4-dihydroxyanthra-9,10-quinone |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C20H15ClO4 |
| InChI |
InChI=1S/C20H15ClO4/c1-3-6-11-14(9-10(2)21)20(25)16-15(17(11)22)18(23)12-7-4-5-8-13(12)19(16)24/h3-5,7-8,22,25H,1-2,6,9H2 |
| InChIKey |
DSMXORFXRMPEJT-UHFFFAOYSA-N |
| Molecular Weight |
354.789 g/mol |
| SMILES |
Oc1c2c(c(c(c1CC=C)CC(=C)Cl)O)C(c1c(C2=O)cccc1)=O |
| SPLASH |
splash10-014i-0009000000-1f14384a0dcba4f54197 |
| Source of Spectrum |
B-47-1321-0 |
| Wiley ID |
1344532 |
