| SpectraBase Spectrum ID |
JOcZSCn3k8t |
| Name |
Sydowinin A, ac derivative |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
342.073952784 u |
| Formula |
C18H14O7 |
| InChI |
InChI=1S/C18H14O7/c1-9(19)24-8-10-6-12(20)16-14(7-10)25-13-5-3-4-11(18(22)23-2)15(13)17(16)21/h3-7,20H,8H2,1-2H3 |
| InChIKey |
HZLNCYGDDJKCMT-UHFFFAOYSA-N |
| Molecular Weight |
342.303 g/mol |
| SMILES |
C1(C2=C(C=CC=C2OC2=C1C(=CC(=C2)COC(=O)C)O)C(=O)OC)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.960419 |
