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(Z)-1-((3r,5r,7r)-Adamantan-1-yl)-2-(benzylthio)vinyl acetate
SpectraBase Compound ID 2YQCgnpc7XI
InChI InChI=1S/C21H26O2S/c1-15(22)23-20(14-24-13-16-5-3-2-4-6-16)21-10-17-7-18(11-21)9-19(8-17)12-21/h2-6,14,17-19H,7-13H2,1H3/b20-14-/t17-,18+,19-,21-
InChIKey HMDSHGZJRPLJMV-MINAFKNBSA-N
Mol Weight 342.5 g/mol
Molecular Formula C21H26O2S
Exact Mass 342.165351 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3Vdsz8HIuuw
Name (Z)-1-((3r,5r,7r)-Adamantan-1-yl)-2-(benzylthio)vinyl acetate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H26O2S
InChI InChI=1S/C21H26O2S/c1-15(22)23-20(14-24-13-16-5-3-2-4-6-16)21-10-17-7-18(11-21)9-19(8-17)12-21/h2-6,14,17-19H,7-13H2,1H3/b20-14-/t17-,18+,19-,21-
InChIKey HMDSHGZJRPLJMV-MINAFKNBSA-N
Literature Reference DOI 10.1039/c4ob01011f
Molecular Weight 342.497 g/mol
SMILES C1[C@]2(CC3(\C(=C\SCc4ccccc4)OC(=O)C)C[C@@]1(C[C@](C3)(C2)[H])[H])[H]
SPLASH splash10-0006-9313000000-dfc1bbeec30390653f76
Source of Spectrum F5-12-6524-26
Wiley ID 1747600