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2-(4-Methoxyphenyl)spiro[1,3,2-benzoxathiaphosphinine-4,2'-adamantane]-2-sulfide
SpectraBase Compound ID FmVVvl6828Z
InChI InChI=1S/C23H25O2PS2/c1-24-19-6-8-20(9-7-19)26(27)25-22-5-3-2-4-21(22)23(28-26)17-11-15-10-16(13-17)14-18(23)12-15/h2-9,15-18H,10-14H2,1H3/t15-,16+,17-,18+,23-,26?
InChIKey LPPVOBIOLJTBIK-PGVYDRMNSA-N
Mol Weight 428.54 g/mol
Molecular Formula C23H25O2PS2
Exact Mass 428.103359 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FgKMnvPi0mW
Name 2-(4-Methoxyphenyl)spiro[1,3,2-benzoxathiaphosphinine-4,2'-adamantane]-2-sulfide
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Formula C23H25O2PS2
InChI InChI=1S/C23H25O2PS2/c1-24-19-6-8-20(9-7-19)26(27)25-22-5-3-2-4-21(22)23(28-26)17-11-15-10-16(13-17)14-18(23)12-15/h2-9,15-18H,10-14H2,1H3/t15-,16+,17-,18+,23-,26?
InChIKey LPPVOBIOLJTBIK-PGVYDRMNSA-N
Molecular Weight 428.545 g/mol
SMILES C12(SP(Oc3c2cccc3)(c2ccc(cc2)OC)=S)[C@]2(C[C@]3(C[C@@]1(C[C@](C3)(C2)[H])[H])[H])[H]
SPLASH splash10-004i-0390100000-6e33e72e037288eb82fd
Source of Spectrum HC-47-905-3h
Synonyms (1R,3S,5r,7r)-2'-(4-methoxyphenyl)spiro[adamantane-2,4'-benzo[e][1,3,2]oxathiaphosphinine] 2'-sulfide
Wiley ID 1734136