SpectraBase Compound ID | JZ4f5vrlpoH |
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InChI | InChI=1S/C15H17Cl2F2NS/c16-15(17)11-5-1-3-7-13(11,8-9-14(15,18)19)21-12-6-2-4-10-20-12/h2,4,6,10-11H,1,3,5,7-9H2/t11-,13-/m1/s1 |
InChIKey | KQGTVRYXLGGAOA-DGCLKSJQSA-N |
Mol Weight | 352.27 g/mol |
Molecular Formula | C15H17Cl2F2NS |
Exact Mass | 351.042682 g/mol |
SpectraBase Spectrum ID | 9C7prb15fNp |
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Name | 1,1-Dichloro-2,2-difluoro-4a-(2-pyridylthio)decahydronaphthalene |
Comments | Less than 3 mono-isotopic peaks |
Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula | C15H17Cl2F2NS |
InChI | InChI=1S/C15H17Cl2F2NS/c16-15(17)11-5-1-3-7-13(11,8-9-14(15,18)19)21-12-6-2-4-10-20-12/h2,4,6,10-11H,1,3,5,7-9H2/t11-,13-/m1/s1 |
InChIKey | KQGTVRYXLGGAOA-DGCLKSJQSA-N |
Molecular Weight | 352.271 g/mol |
SMILES | C1([C@]2([C@@](Sc3ncccc3)(CCCC2)CCC1(F)F)[H])(Cl)Cl |
SPLASH | splash10-03di-0900000000-74d88601eaddf712c8d6 |
Source of Spectrum | J-62-7199-7 |
Synonyms | 1,1-dichloro-2,2-difluorooctahydro-4a(2H)-naphthalenyl 2-pyridinyl sulfide 2-((4aR,8aR)-1,1-Dichloro-2,2-difluoro-octahydro-naphthalen-4a-ylsulfanyl)-pyridine 2-[(1,1-dichloro-2,2-difluorooctahydro-4a(2H)-naphthalenyl)sulfanyl]pyridine 2-[[(4aR,8aR)-8,8-dichloro-7,7-difluoro-2,3,4,5,6,8a-hexahydro-1H-naphthalen-4a-yl]thio]pyridine 2-[[(4aR,8aR)-8,8-dichloro-7,7-difluoro-2,3,4,5,6,8a-hexahydro-1H-naphthalen-4a-yl]sulfanyl]pyridine 2-[(4aR,8aR)-1,1-dichloro-2,2-difluoro-decalin-4a-yl]sulfanylpyridine 2-[[(4aR,8aR)-8,8-bis(chloranyl)-7,7-bis(fluoranyl)-2,3,4,5,6,8a-hexahydro-1H-naphthalen-4a-yl]sulfanyl]pyridine |
Wiley ID | 1342459 |