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Caryophyllene-4(14),8(15)-diene <5,6-dihydroxy->, di-TMS, isomer 1
SpectraBase Compound ID I0kUujP36em
InChI InChI=1S/C21H40O2Si2/c1-15-11-12-18-17(14-21(18,3)4)16(2)13-19(22-24(5,6)7)20(15)23-25(8,9)10/h17-20H,1-2,11-14H2,3-10H3
InChIKey SETICDGCYXMNST-UHFFFAOYSA-N
Mol Weight 380.7 g/mol
Molecular Formula C21H40O2Si2
Exact Mass 380.256684 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KgSISSshoE8
Name Caryophyllene-4(14),8(15)-diene <5,6-dihydroxy->, di-TMS, isomer 2
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 380.256683596 u
Formula C21H40O2Si2
GC Column HP-5ms (30 m × 0.25 mm ID x 0.25 μm film thickness)
InChI InChI=1S/C21H40O2Si2/c1-15-11-12-18-17(14-21(18,3)4)16(2)13-19(22-24(5,6)7)20(15)23-25(8,9)10/h17-20H,1-2,11-14H2,3-10H3
InChIKey SETICDGCYXMNST-UHFFFAOYSA-N
Molecular Weight 380.719 g/mol
Nominal Mass 380 u
Number of Peaks 216
SMILES C1(C(O[Si](C)(C)C)C(CCC2C(C(C1)=C)CC2(C)C)=C)O[Si](C)(C)C
SPLASH splash10-00di-6940000000-d2fef276dffdc74a804f
Source birch (B. pubescens) buds
Source of Spectrum Biologically and Environmentally Important Organic Compounds: GCMS Library
Synonyms 5,6-Dihydroxy-caryophyllene-4(14),8(15)-diene, di-TMS, isomer 2
Wiley ID VI001060