| SpectraBase Compound ID | 6V5wL2TXr13 |
|---|---|
| InChI | InChI=1S/C23H31N3S/c1-13-5-18-7-14(1)8-19(6-13)21(18)25-26-22-24-20(12-27-22)23-9-15-2-16(10-23)4-17(3-15)11-23/h12-19H,1-11H2,(H,24,26)/b25-21-/t13-,14+,15-,16+,17-,18-,19+,23- |
| InChIKey | OXZJLHWBMATFFI-TWVPEJHBSA-N |
| Mol Weight | 381.58 g/mol |
| Molecular Formula | C23H31N3S |
| Exact Mass | 381.223869 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | EI0uX6XhIVB |
|---|---|
| Name | 1-((2-Adamantanylidenehydrazinyl)thiazol-4-yl)adamantane |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C23H31N3S |
| InChI | InChI=1S/C23H31N3S/c1-13-5-18-7-14(1)8-19(6-13)21(18)25-26-22-24-20(12-27-22)23-9-15-2-16(10-23)4-17(3-15)11-23/h12-19H,1-11H2,(H,24,26)/b25-21-/t13-,14+,15-,16+,17-,18-,19+,23- |
| InChIKey | OXZJLHWBMATFFI-TWVPEJHBSA-N |
| Instrument Name | Waters AutoSpec Premier |
| Ionization Type | EI positive ion |
| Literature Reference DOI | 10.1002/jhet.2364 |
| Molecular Weight | 381.582 g/mol |
| Reported Formula | C23H31N3S |
| SMILES | N(c1scc(C23C[C@]4(C[C@@](C3)(C[C@@](C2)(C4)[H])[H])[H])n1)N=C1[C@]2(C[C@]3(C[C@@]1(C[C@](C3)(C2)[H])[H])[H])[H] |
| SPLASH | splash10-001i-3259000000-e0c27aec8c5d46145205 |
| Source of Spectrum | Y-53-447-3k |
| Wiley ID | 1877662 |