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APSIDINOL
SpectraBase Compound ID 8MnQVL5WNxu
InChI InChI=1S/C12H16O4/c1-4-5-8(13)11-9(14)6-10(16-3)7(2)12(11)15/h6,14-15H,4-5H2,1-3H3
InChIKey GJRJTYFSORWKBE-UHFFFAOYSA-N
Mol Weight 224.26 g/mol
Molecular Formula C12H16O4
Exact Mass 224.104859 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FJvsFJhbpps
Name 1-(2,6-dihydroxy-4-methoxy-3-methyl-phenyl)butan-1-one
CAS Registry Number 57765-53-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H16O4
InChI InChI=1S/C12H16O4/c1-4-5-8(13)11-9(14)6-10(16-3)7(2)12(11)15/h6,14-15H,4-5H2,1-3H3
InChIKey GJRJTYFSORWKBE-UHFFFAOYSA-N
Molecular Weight 224.256 g/mol
SMILES Oc1c(c(c(c(c1)OC)C)O)C(=O)CCC
SPLASH splash10-001i-4920000000-861ecd155e4296217054
Source of Spectrum CD-570-0-0
Synonyms 1-(2,6-Dihydroxy-4-methoxy-3-methylphenyl)-1-butanone 1-[4-methoxy-3-methyl-2,6-bis(oxidanyl)phenyl]butan-1-one Aspidinol
Wiley ID 1224921