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Elemicin
SpectraBase Compound ID 18yIi7OgpvR
InChI InChI=1S/C12H16O3/c1-5-6-9-7-10(13-2)12(15-4)11(8-9)14-3/h5,7-8H,1,6H2,2-4H3
InChIKey BPLQKQKXWHCZSS-UHFFFAOYSA-N
Mol Weight 208.26 g/mol
Molecular Formula C12H16O3
Exact Mass 208.109944 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HoO5AXxVKBr
Name Elemicin
Source of Sample SAFC Cat. #W283606
CAS Registry Number 487-11-6
Classification Pheromones
Copyright Copyright © 2016-2024  John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H16O3
InChI InChI=1S/C12H16O3/c1-5-6-9-7-10(13-2)12(15-4)11(8-9)14-3/h5,7-8H,1,6H2,2-4H3
InChIKey BPLQKQKXWHCZSS-UHFFFAOYSA-N
Number of Peaks 50
RI1 1551
SMILES COc1c(OC)cc(CC=C)cc1OC
SPLASH splash10-0a6u-6930000000-2015d1493ff6273e1a08
Source of Spectrum Prof. L. Mondello (Chromaleont s.r.l./Univ. Messina, Italy)
Synonyms Benzene, 1,2,3-trimethoxy-5-(2-propenyl)-
Wiley ID LM_PEST_1166