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(2S*,8S)-2-Pentyl-8-[6-(R,S)-tetrahydropyranyloxyhex-2-ynyl]oxocane
SpectraBase Compound ID z0X0fKfFFa
InChI InChI=1S/C23H40O3/c1-2-3-7-14-21-16-9-6-10-17-22(26-21)15-8-4-5-12-19-24-23-18-11-13-20-25-23/h21-23H,2-3,5-7,9-20H2,1H3/t21-,22+,23?/m0/s1
InChIKey KOQYDSBJSXIOBY-ZVTBYLAHSA-N
Mol Weight 364.6 g/mol
Molecular Formula C23H40O3
Exact Mass 364.297745 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9Osk9l0fkZ8
Name (2S*,8S)-2-Pentyl-8-[6-(R,S)-tetrahydropyranyloxyhex-2-ynyl]oxocane
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H40O3
InChI InChI=1S/C23H40O3/c1-2-3-7-14-21-16-9-6-10-17-22(26-21)15-8-4-5-12-19-24-23-18-11-13-20-25-23/h21-23H,2-3,5-7,9-20H2,1H3/t21-,22+,23?/m0/s1
InChIKey KOQYDSBJSXIOBY-ZVTBYLAHSA-N
Molecular Weight 364.570 g/mol
SMILES C(#CCCCOC1OCCCC1)C[C@]1(O[C@@](CCCCC)(CCCCC1)[H])[H]
SPLASH splash10-000i-9000000000-6a37f00283464b975357
Source of Spectrum KC-0-99-12
Synonyms (2S,8S)-2-pentyl-8-{6-[(2R)-tetrahydro-2H-pyran-2-yloxy]-2-hexynyl}oxocane 6-[(2S,8S)-8-pentyloxocanyl]-4-hexynyl (2R)-tetrahydro-2H-pyran-2-yl ether
Wiley ID 775843