naphthalenophane, N-methyl-2,8-dithia-](/api/spectrum/3gxZDqmMndw/structure.png?h=300&w=458 "5-Aza[9](1,5)naphthalenophane, N-methyl-2,8-dithia-")
| SpectraBase Compound ID | 1FSkKu0xyUC |
|---|---|
| InChI | InChI=1S/C17H21NS2/c1-18-8-10-19-12-14-4-2-6-16-15(13-20-11-9-18)5-3-7-17(14)16/h2-7H,8-13H2,1H3 |
| InChIKey | DZBBDNSDGBCPGY-UHFFFAOYSA-N |
| Mol Weight | 303.48 g/mol |
| Molecular Formula | C17H21NS2 |
| Exact Mass | 303.111542 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 3gxZDqmMndw |
|---|---|
| Name | 5-Aza[9](1,5)naphthalenophane, N-methyl-2,8-dithia- |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C17H21NS2 |
| InChI | InChI=1S/C17H21NS2/c1-18-8-10-19-12-14-4-2-6-16-15(13-20-11-9-18)5-3-7-17(14)16/h2-7H,8-13H2,1H3 |
| InChIKey | DZBBDNSDGBCPGY-UHFFFAOYSA-N |
| Molecular Weight | 303.482 g/mol |
| SMILES | C1SCCN(CCSCc2cccc3c2cccc13)C |
| SPLASH | splash10-0udi-2910000000-4f6c92fdb31624b57d91 |
| Source of Spectrum | HE-1982-0-0 |
| Wiley ID | 1305675 |