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Humulene <14-Hydroxy-.alpha.-> acetate
SpectraBase Compound ID CpsZzj46szb
InChI InChI=1S/C17H26O2/c1-14-7-5-8-16(13-19-15(2)18)9-6-11-17(3,4)12-10-14/h6,8,10-11H,5,7,9,12-13H2,1-4H3/b11-6+,14-10+,16-8-
InChIKey HRJAXTXFMJCTOQ-AOVTVKOZSA-N
Mol Weight 262.39 g/mol
Molecular Formula C17H26O2
Exact Mass 262.19328 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3kDkXCA1GeM
Name Humulene <14-Hydroxy-.alpha.-> acetate
Copyright Database Compilation Copyright © 2023-2024 John Wiley and Sons, Inc. Copyright © 2023-2024 John Wiley and Sons, Inc., Portions Copyright Wiley-VCH GmbH, Adams Library under license from Diablo Analytical. All Rights Reserved.
Exact Mass 262.193280075 u
Formula C17H26O2
GC Column HP-5ms (30 m × 0.25 mm ID x 0.25 μm film thickness)
InChI InChI=1S/C17H26O2/c1-14-7-5-8-16(13-19-15(2)18)9-6-11-17(3,4)12-10-14/h6,8,10-11H,5,7,9,12-13H2,1-4H3/b11-6+,14-10+,16-8-
InChIKey HRJAXTXFMJCTOQ-AOVTVKOZSA-N
Molecular Weight 262.393 g/mol
Nominal Mass 262 u
Number of Peaks 168
SMILES C1\C(=C\CC\C(=C\CC(\C=C\1)(C)C)C)COC(=O)C
SPLASH splash10-001l-9700000000-f18204868ef9195d570c
Source birch (Betula pubescens) buds
Source of Spectrum Biologically and Environmentally Important Organic Compounds: GCMS Library
Synonyms 14-Hydroxy-.alpha.-humulene acetate
Wiley ID VI000295