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Xenitorin D
SpectraBase Compound ID AwIDby76WA1
InChI InChI=1S/C15H24O2/c1-8(2)12-10-7-9(3)5-6-11(10)15(4)14(17-15)13(12)16/h9-14,16H,1,5-7H2,2-4H3/t9-,10+,11+,12-,13-,14-,15+/m0/s1
InChIKey AGVVMVNNMJUBCX-HIDDOJLPSA-N
Mol Weight 236.35 g/mol
Molecular Formula C15H24O2
Exact Mass 236.17763 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5MVg4OeOvAp
Name Xenitorin D
Appearance Colorless oil
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H24O2
InChI InChI=1S/C15H24O2/c1-8(2)12-10-7-9(3)5-6-11(10)15(4)14(17-15)13(12)16/h9-14,16H,1,5-7H2,2-4H3/t9-,10+,11+,12-,13-,14-,15+/m0/s1
InChIKey AGVVMVNNMJUBCX-HIDDOJLPSA-N
Instrument Name JEOL JMS-SX/SX 102A
Ionization Type EI
Literature Reference DOI 10.1021/np0203281
Molecular Weight 236.355 g/mol
Optical Rotation [a]D25 = -39 (c = 0.16, CHCl3)
Reported Formula C15H24O2
SMILES O[C@@]1([C@]2([C@]([C@@]3(CC[C@@](C[C@]3([C@@]1(C(C)=C)[H])[H])(C)[H])[H])(C)O2)[H])[H]
SPLASH splash10-03e9-0910000000-bd4759550417df34db29
Source of Spectrum G4-65-1856-4
Wiley ID 1883585