| SpectraBase Spectrum ID |
3nReQa8N45N |
| Name |
2,9,12,19-tetrakis(Benzoyloxy)-10,11-O-isopropylidene-icosa-6,11-diene-10,11-diol |
| Alternate Name(s) |
2,9,12,19-tetrakis(Benzoyloxy)-10,11-O-isopropyl-icosa-6,14-diene-10,11-diol
8-(benzoyloxy)-1-[(4Z)-5-[(3E)-1,8-bis(benzoyloxy)non-3-en-1-yl]-2,2-dimethyl-1,3-dioxolan-4-ylidene]nonyl benzoate |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C51H58O10 |
| InChI |
InChI=1S/C51H58O10/c1-37(56-47(52)39-27-15-9-16-28-39)25-13-5-7-23-35-43(58-49(54)41-31-19-11-20-32-41)45-46(61-51(3,4)60-45)44(59-50(55)42-33-21-12-22-34-42)36-24-8-6-14-26-38(2)57-48(53)40-29-17-10-18-30-40/h7-12,15-24,27-34,37-38,43-46H,5-6,13-14,25-26,35-36H2,1-4H3/b23-7+,24-8+ |
| InChIKey |
YDIKDTMLCSMNCR-ZPNKGADNSA-N |
| Molecular Weight |
831.015 g/mol |
| SMILES |
C1(C(OC(O1)(C)C)C(OC(=O)c1ccccc1)C\C=C\CCCC(OC(=O)c1ccccc1)C)C(OC(=O)c1ccccc1)C\C=C\CCCC(OC(=O)c1ccccc1)C |
| SPLASH |
splash10-0a4i-1900000000-e620bbf338aa45c3f43c |
| Source of Spectrum |
AC-1990-802-5 |
| Wiley ID |
747864 |
