| SpectraBase Spectrum ID |
J4GAegkBUpk |
| Name |
1,15-Diaza-3,4;12,13-dibenzo-16,18-(p-ethylbenzoato)-8-oxa-5,11-dithiacyclooctadecane-2,14-dione |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C27H26N2O5S2 |
| InChI |
InChI=1S/C27H26N2O5S2/c1-2-34-27(32)19-12-11-18-17-22(19)29-26(31)21-8-4-6-10-24(21)36-16-14-33-13-15-35-23-9-5-3-7-20(23)25(30)28-18/h3-12,17H,2,13-16H2,1H3,(H,28,30)(H,29,31) |
| InChIKey |
VUPXUVXOWFYENY-UHFFFAOYSA-N |
| Molecular Weight |
522.634 g/mol |
| SMILES |
N1c2cc(NC(c3c(SCCOCCSc4c(C1=O)cccc4)cccc3)=O)ccc2C(=O)OCC |
| SPLASH |
splash10-0006-9000000000-01a0a8b477e1d46c2b01 |
| Source of Spectrum |
C5-2004-603-11 |
| Wiley ID |
1616648 |
