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3-(7-Acetyl-6-hydroxy-2,5-dimethyl-1-benzofuran-3-yl)-2,4-pentanedione
SpectraBase Compound ID IM7P5wUsfid
InChI InChI=1S/C17H18O5/c1-7-6-12-15(13(8(2)18)9(3)19)11(5)22-17(12)14(10(4)20)16(7)21/h6,13,21H,1-5H3
InChIKey MNLUGDKGHYJSEB-UHFFFAOYSA-N
Mol Weight 302.33 g/mol
Molecular Formula C17H18O5
Exact Mass 302.115424 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FI8YooVssSE
Name 3-(7-Acetyl-6-hydroxy-2,5-dimethyl-1-benzofuran-3-yl)-2,4-pentanedione
CAS Registry Number 66395-48-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H18O5
InChI InChI=1S/C17H18O5/c1-7-6-12-15(13(8(2)18)9(3)19)11(5)22-17(12)14(10(4)20)16(7)21/h6,13,21H,1-5H3
InChIKey MNLUGDKGHYJSEB-UHFFFAOYSA-N
Molecular Weight 302.326 g/mol
SMILES Oc1c(C)cc2c(c(C)oc2c1C(C)=O)C(C(C)=O)C(C)=O
SPLASH splash10-0udi-0097000000-ff7cc26c6e571ba389b2
Source of Spectrum W5-1989-6588-1
Synonyms 3-(7-acetyl-6-hydroxy-2,5-dimethyl-1-benzofuran-3-yl)pentane-2,4-dione 3-(7-acetyl-6-hydroxy-2,5-dimethyl-3-benzofuranyl)pentane-2,4-dione 3-(7-acetyl-6-hydroxy-2,5-dimethyl-benzofuran-3-yl)pentane-2,4-dione 3-(7-Ethanoyl-2,5-dimethyl-6-oxidanyl-1-benzofuran-3-yl)pentane-2,4-dione 7-Acetyl-3-(diacetylmethyl)-6-hydroxy-2,5-dimethylbenzofuran
Wiley ID 1304651