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cis-Methoxyconidiol
SpectraBase Compound ID Gwxi1U3H2Bk
InChI InChI=1S/C17H24O3/c1-11-5-7-15(17(2,3)20-4)13(9-11)14-10-12(18)6-8-16(14)19/h6,8-10,13,15,18-19H,5,7H2,1-4H3/t13-,15-/m1/s1
InChIKey YVRSQIWWSKXPTR-UKRRQHHQSA-N
Mol Weight 276.38 g/mol
Molecular Formula C17H24O3
Exact Mass 276.172545 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 49Q43qDLxud
Name cis-Methoxyconidiol
Appearance Yellow oil
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H24O3
InChI InChI=1S/C17H24O3/c1-11-5-7-15(17(2,3)20-4)13(9-11)14-10-12(18)6-8-16(14)19/h6,8-10,13,15,18-19H,5,7H2,1-4H3/t13-,15-/m1/s1
InChIKey YVRSQIWWSKXPTR-UKRRQHHQSA-N
Ionization Type EI
Literature Reference DOI 10.1021/np050110p
Molecular Weight 276.376 g/mol
Optical Rotation [a]D23 = +6.4 (c = 2*10(-5), CHCl3)
Reported Formula C17H24O3
SMILES Oc1c(cc(cc1)O)[C@]1(C=C(CC[C@]1(C(C)(C)OC)[H])C)[H]
SPLASH splash10-0229-9470000000-5755eabab6a4fc6bad19
Source of Spectrum G4-68-1414-1
Wiley ID 1882092