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5-ACETOXY-5,6-DIHYDRO-6,14-DEHYDROCARYOPHYLLENE
SpectraBase Compound ID LyGkmAOTaS
InChI InChI=1S/C17H26O2/c1-11-7-9-16(19-13(3)18)12(2)6-8-15-14(11)10-17(15,4)5/h14-16H,1-2,6-10H2,3-5H3
InChIKey MWERDWMFVGCBLL-UHFFFAOYSA-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 4JbGY15hD6
Name Caryophylladien-5.alpha.-ol 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/c1-11-7-9-16(19-13(3)18)12(2)6-8-15-14(11)10-17(15,4)5/h14-16H,1-2,6-10H2,3-5H3
InChIKey MWERDWMFVGCBLL-UHFFFAOYSA-N
Molecular Weight 262.393 g/mol
Nominal Mass 262 u
Number of Peaks 74
SMILES C1C2C(C(CCC(C(C1)=C)OC(C)=O)=C)CC2(C)C
SPLASH splash10-000x-7900000000-4ad088473f0777f4a900
Source birch (B. pubescens) buds
Source of Spectrum Biologically and Environmentally Important Organic Compounds: GCMS Library
Wiley ID VI000840