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CARYOPHYLLIN-EPOXID
SpectraBase Compound ID 4tUt1rvMLCW
InChI InChI=1S/C15H24O/c1-10-5-6-13-15(4,16-13)8-7-12-11(10)9-14(12,2)3/h11-13H,1,5-9H2,2-4H3
InChIKey NVEQFIOZRFFVFW-UHFFFAOYSA-N
Mol Weight 220.36 g/mol
Molecular Formula C15H24O
Exact Mass 220.182715 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9ryPCqI7MBI
Name Caryophyllene oxide
Source of Sample SAFC Cat.no. W509647
CAS Registry Number 1139-30-6
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 220.182715392 u
Formula C15H24O
InChI InChI=1S/C15H24O/c1-10-5-6-13-15(4,16-13)8-7-12-11(10)9-14(12,2)3/h11-13H,1,5-9H2,2-4H3
InChIKey NVEQFIOZRFFVFW-UHFFFAOYSA-N
Molecular Weight 220.356 g/mol
Number of Peaks 50
RI1 1587
RI2 1265
RI3 1364
RI4 1325
RI5 1567
SMILES C12CCC3(OC3CCC(C1CC2(C)C)=C)C
SPLASH splash10-0006-9300000000-73007a6f376689143d3f
Sample Comments RI1: measured on SLB-5ms (Hydro) RI2: measured on SLB-5ms (FAMEs) RI3: measured on Supelcowax-10 (FAMEs) RI4: measured on Supelcowax-10 (FAEEs) RI5: measured on Equity-1 (Hydro)
Source of Spectrum Prof. L. Mondello (Chromaleont s.r.l./Univ. Messina, Italy)
Synonyms 5-Oxatricyclo[8.2.0.04,6]dodecane, 4,12,12-trimethyl-9-methylene-
Wiley ID LM_FFNSC3_145