| SpectraBase Spectrum ID |
6tdfzgx2LJ0 |
| Name |
endo-7-Ethylenedioxy-2,4-dimethyl-5-phenylthiohexahydroisoindole-1,3-dione |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C18H19NO4S |
| InChI |
InChI=1S/C18H19NO4S/c1-11-13(24-12-6-4-3-5-7-12)10-18(22-8-9-23-18)15-14(11)16(20)19(2)17(15)21/h3-7,10-11,14-15H,8-9H2,1-2H3/t11-,14?,15?/m0/s1 |
| InChIKey |
MAZFJTKHXNAHHB-QGLTVNCISA-N |
| Molecular Weight |
345.413 g/mol |
| SMILES |
C12C(N(C)C(C2[C@](C(Sc2ccccc2)=CC11OCCO1)(C)[H])=O)=O |
| SPLASH |
splash10-004i-0901000000-3d769aa120904c7ad4d7 |
| Source of Spectrum |
AT-34-4590-0 |
| Wiley ID |
852593 |
