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α-Asarone
SpectraBase Compound ID 6xK1hGhPK6I
InChI InChI=1S/C12H16O3/c1-5-6-9-7-11(14-3)12(15-4)8-10(9)13-2/h5-8H,1-4H3/b6-5+
InChIKey RKFAZBXYICVSKP-AATRIKPKSA-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 GWHeEOHweJ6
Name Asarone
CAS Registry Number 2883-98-9
Classification Flavor
Comments Spectrum verified by crosschecking against external libraries (one reference spectrum with similarity >= 99% found); Spectrum verified by independent measurements in external laboratories
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 208.109944372 u
Formula C12H16O3
InChI InChI=1S/C12H16O3/c1-5-6-9-7-11(14-3)12(15-4)8-10(9)13-2/h5-8H,1-4H3/b6-5+
InChIKey RKFAZBXYICVSKP-AATRIKPKSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 208.257 g/mol
Nominal Mass 208 u
Quality 997
Retention Index 1500
SMILES C1(=C(C=C(C(=C1)OC)OC)\C=C\C)OC
SPLASH splash10-0a4l-8930000000-853e6b2023a6b8be16bb
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms Benzene,1,2,4-trimethoxy-5-(1-propenyl)- 1,2,4-Trimethoxy-5-[(E)-prop-1-enyl]benzene
Technique GC/MS
Wiley ID DD2024_017444