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Aristoyunnolin E

View entire compound with spectra: 1 MS (GC)

Aristoyunnolin E
SpectraBase Compound ID JIUDUOq8Ipc
InChI InChI=1S/C15H22O2/c1-12-5-3-7-13(2)9-15(17)10-14(11-16)8-4-6-12/h6-7,10-11,15,17H,3-5,8-9H2,1-2H3/b12-6+,13-7+,14-10+
InChIKey ZHBYOYWMNXDEEV-MMNDEXPJSA-N
Mol Weight 234.34 g/mol
Molecular Formula C15H22O2
Exact Mass 234.16198 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7mvu2LGS0a1
Name Aristoyunnolin E
Appearance Colorless oil
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H22O2
InChI InChI=1S/C15H22O2/c1-12-5-3-7-13(2)9-15(17)10-14(11-16)8-4-6-12/h6-7,10-11,15,17H,3-5,8-9H2,1-2H3/b12-6+,13-7+,14-10+
InChIKey ZHBYOYWMNXDEEV-MMNDEXPJSA-N
Instrument Name Finnigan MAT 95
Ionization Type EI
Literature Reference DOI 10.1021/np300887d
Molecular Weight 234.339 g/mol
Optical Rotation [a]20D = -117 (c = 0.34, CHCl3)
Reported Formula C15H22O2
SMILES OC1C\C(=C\CC\C(=C\CC\C(=C/1)C=O)C)C
SPLASH splash10-00rf-0930000000-fdc9d52d7e1fa1f29b3c
Source of Spectrum G4-76-669-5
Wiley ID 1854909