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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 3G3mS2iDSRA
Name 1-(3,4-Dimethoxyphenyl)-1-propene
CAS Registry Number 93-16-3
Classification Designer drug precursor
Comments Spectrum verified by independent measurements in external laboratories
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. 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
Ionization Type Electron Ionization (EI)
Molecular Weight 178.231 g/mol
Nominal Mass 178 u
Quality 996
Retention Index 1291
SMILES C=1(C(=CC=C(C1)\C=C\C)OC)OC
SPLASH splash10-004i-7900000000-69c62e055f1931fa588a
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms 1-(3,4-Dimethoxyphenyl)prop-1-ene 1,2-Dimethoxy-4-[(1E)-1-propen-1-yl]benzene
Technique GC/MS
Wiley ID DD2024_027576