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(+)-4-EPI-ALPHA-BISABOLOL;(4R,8S)-BISABOLA-1(7),12(13)-DIEN-8-OL
SpectraBase Compound ID 31pflIF7szA
InChI InChI=1S/C15H26O/c1-12(2)6-5-11-15(4,16)14-9-7-13(3)8-10-14/h6-7,14,16H,5,8-11H2,1-4H3/t14-,15+/m0/s1
InChIKey RGZSQWQPBWRIAQ-LSDHHAIUSA-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 9HksLL98bJw
Name .alpha.-Bisabolol
Carrier Gas Helium (1.0 mL/min)
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 222.198365456 u
Formula C15H26O
GC Column DB-5MS (30 m x 0.25 mm, film thickness 0.25 micrometer)
GC Oven Program Oven temp 250oC
InChI InChI=1S/C15H26O/c1-12(2)6-5-11-15(4,16)14-9-7-13(3)8-10-14/h6-7,14,16H,5,8-11H2,1-4H3/t14-,15+/m0/s1
InChIKey RGZSQWQPBWRIAQ-LSDHHAIUSA-N
Inlet Type split (20:1)
Instrument Name Shimadzu GC/MS-QP 2010SE
Ionization Type EI
Literature Reference DOI 10.1002/cbdv.202300793
Molecular Weight 222.372 g/mol
Quality 579
SMILES O[C@@]([C@@]1(CCC(=CC1)C)[H])(CCC=C(C)C)C
SPLASH splash10-05mo-9400000000-b3a69ce974936a08f5b5
Source of Spectrum CBD-20-SM3-No-44 (DOI: 10.1002/cbdv.202300793)
Wiley ID 1909972