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9-Hydroxybisabolol oxide A
SpectraBase Compound ID FLw5GdH02xH
InChI InChI=1S/C15H26O3/c1-13(2)12(16)7-10-15(4,18-13)11-5-8-14(3,17)9-6-11/h5,8,11-12,16-17H,6-7,9-10H2,1-4H3/t11-,12+,14+,15+/m1/s1
InChIKey FUFCOMVTKVHPIF-DHMWGJHJSA-N
Mol Weight 254.37 g/mol
Molecular Formula C15H26O3
Exact Mass 254.188195 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GSUbMH1MDio
Name 9-Hydroxybisabolol oxide A
Appearance Yellowish oil
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H26O3
InChI InChI=1S/C15H26O3/c1-13(2)12(16)7-10-15(4,18-13)11-5-8-14(3,17)9-6-11/h5,8,11-12,16-17H,6-7,9-10H2,1-4H3/t11-,12+,14+,15+/m1/s1
InChIKey FUFCOMVTKVHPIF-DHMWGJHJSA-N
Instrument Name Agilent 7890AGC-5975C
Ionization Type EI
Literature Reference DOI 10.1021/np4003349
Molecular Weight 254.370 g/mol
Optical Rotation [a]D20 = +1.8 (c = 0.20, CHCl3)
Reported Formula C15H26O3
SMILES O[C@@]1(CC[C@]([C@@]2(CC[C@@](C(O2)(C)C)(O)[H])C)(C=C1)[H])C
SPLASH splash10-0006-9700000000-6308c5fafedc702395c8
Source of Spectrum G4-76-SM14-1
Wiley ID 1865646