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1-Acetyl-2-hydroxy-4,7-dimethyl-octa-4(E),6-diene-2-carboxylic acid methyl ester

View entire compound with spectra: 1 MS (GC)

1-Acetyl-2-hydroxy-4,7-dimethyl-octa-4(E),6-diene-2-carboxylic acid methyl ester
SpectraBase Compound ID FmRnen4d07E
InChI InChI=1S/C14H22O4/c1-10(2)6-7-11(3)8-14(17,9-12(4)15)13(16)18-5/h6-7,17H,8-9H2,1-5H3/b11-7+
InChIKey XTDPYCLTMXXXSQ-YRNVUSSQSA-N
Mol Weight 254.33 g/mol
Molecular Formula C14H22O4
Exact Mass 254.151809 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BONs59oqEjm
Name 1-Acetyl-2-hydroxy-4,7-dimethyl-octa-4(E),6-diene-2-carboxylic acid methyl ester
Alternate Name(s) Methyl (4E)-2-hydroxy-4,7-dimethyl-2-(2-oxopropyl)-4,6-octadienoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H22O4
InChI InChI=1S/C14H22O4/c1-10(2)6-7-11(3)8-14(17,9-12(4)15)13(16)18-5/h6-7,17H,8-9H2,1-5H3/b11-7+
InChIKey XTDPYCLTMXXXSQ-YRNVUSSQSA-N
Molecular Weight 254.326 g/mol
SMILES OC(C(=O)OC)(CC(=O)C)C\C(=C\C=C(C)C)C
SPLASH splash10-0a4l-6910000000-2393c288059e5f3e81e4
Source of Spectrum AJ-63-1615-9
Wiley ID 1257724