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6-HYDROXY-2-BRASILENE
SpectraBase Compound ID 7JM50XRdeoh
InChI InChI=1S/C15H26O/c1-10(2)12-8-14(4,5)9-13-11(3)6-7-15(12,13)16/h9-12,16H,6-8H2,1-5H3/t11-,12-,15+/m1/s1
InChIKey XDLCURIUCCHLSA-JMSVASOKSA-N
Mol Weight 222.37 g/mol
Molecular Formula C15H26O
Exact Mass 222.198365 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LGF5rWgZayn
Name 6-Hydroxy-1-brasilene
Appearance Colorless oil
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H26O
InChI InChI=1S/C15H26O/c1-10(2)12-8-14(4,5)9-13-11(3)6-7-15(12,13)16/h9-12,16H,6-8H2,1-5H3/t11-,12-,15+/m1/s1
InChIKey XDLCURIUCCHLSA-JMSVASOKSA-N
Instrument Name Hewlett-Packard 5973 or thermo electron corporation DSQ
Ionization Type EI
Literature Reference DOI 10.1021/np900298a
Molecular Weight 222.372 g/mol
Optical Rotation [a]D20 = -70 (c = 0.05, CHCl3)
Reported Formula C15H26O
SMILES O[C@@]12CC[C@](C2=CC(C[C@@]1(C(C)C)[H])(C)C)(C)[H]
SPLASH splash10-000i-2900000000-d554ee54eea6b1138499
Source of Spectrum G4-72-SM5-1
Wiley ID 1872275