| SpectraBase Spectrum ID |
EspqXLLhzVR |
| Name |
2-(7,8-Dimethyl-1,5-dihydro-2,4-benzodithiepin-3-yl)-6-nitrophenol |
| Alternate Name(s) |
Phenol, 2-(1,5-dihydro-7,8-dimethyl-2,4-benzodithiepin-3-yl)-6-nitro- |
| CAS Registry Number |
309286-71-3 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C17H17NO3S2 |
| InChI |
InChI=1S/C17H17NO3S2/c1-10-6-12-8-22-17(23-9-13(12)7-11(10)2)14-4-3-5-15(16(14)19)18(20)21/h3-7,17,19H,8-9H2,1-2H3 |
| InChIKey |
IYKNAMAXZLQEBE-UHFFFAOYSA-N |
| Molecular Weight |
347.447 g/mol |
| SMILES |
Oc1c(C2SCc3cc(C)c(cc3CS2)C)cccc1N(=O)=O |
| SPLASH |
splash10-01pk-3920000000-3cd5c0eb04eaa488ef44 |
| Source of Spectrum |
AD-0-2532-0 |
| Wiley ID |
1431085 |
