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epi-Velatumolide
SpectraBase Compound ID 93cq5eSV5MS
InChI InChI=1S/C15H20O4/c1-8-7-18-14(17)11(8)12-15(3)9(2)5-4-6-10(15)13(16)19-12/h9-10,12H,4-7H2,1-3H3/t9-,10-,12+,15+/m0/s1
InChIKey LMDDBANVFKFESY-LFIJZLDSSA-N
Mol Weight 264.32 g/mol
Molecular Formula C15H20O4
Exact Mass 264.136159 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HZTMqNLxqXs
Name epi-Velatumolide
Appearance Colorless prisms
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H20O4
InChI InChI=1S/C15H20O4/c1-8-7-18-14(17)11(8)12-15(3)9(2)5-4-6-10(15)13(16)19-12/h9-10,12H,4-7H2,1-3H3/t9-,10-,12+,15+/m0/s1
InChIKey LMDDBANVFKFESY-LFIJZLDSSA-N
Instrument Name Bruker Daltonics Analysis 3.2
Ionization Type EI
Literature Reference DOI 10.1021/np200188w
Molecular Weight 264.321 g/mol
Optical Rotation [a]D25 = +80.8 (c = 0.24, CHCl3)
Reported Formula C15H20O4
SMILES C1C[C@@]2([C@@]([C@](C1)(C)[H])([C@@](OC2=O)([H])C=1C(OCC1C)=O)C)[H]
SPLASH splash10-03di-0910000000-487f9202e1974f30dc18
Source of Spectrum G4-74-1587-2
Wiley ID 1849192