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(E)-Methyl isoeugenol
SpectraBase Compound ID 4u1UUkWOwbs
InChI InChI=1S/C11H14O2/c1-4-5-9-6-7-10(12-2)11(8-9)13-3/h4-8H,1-3H3/b5-4+
InChIKey NNWHUJCUHAELCL-SNAWJCMRSA-N
Mol Weight 178.23 g/mol
Molecular Formula C11H14O2
Exact Mass 178.09938 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Lb4inSZQZA9
Name Isoeugenol
Source of Sample SAFC Cat. #W247618
CAS Registry Number 93-16-3
Classification Pesticides: Insecticides
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 178.099379689 u
Formula C11H14O2
InChI InChI=1S/C11H14O2/c1-4-5-9-6-7-10(12-2)11(8-9)13-3/h4-8H,1-3H3/b5-4+
InChIKey NNWHUJCUHAELCL-SNAWJCMRSA-N
Molecular Weight 178.231 g/mol
Number of Peaks 50
RI1 1496
SMILES COc1c(OC)ccc(c1)\C=C\C
SPLASH splash10-056r-6900000000-6947a3c4f21dcfd992c7
Sample Comments RI1: measured on SLB-5ms (Alkanes) RI2: measured on Equity-1 (Alkanes)
Source of Spectrum Prof. L. Mondello (Chromaleont s.r.l./Univ. Messina, Italy)
Synonyms Benzene, 1,2-dimethoxy-4-(2-propenyl)-
Wiley ID LM_PEST_1171