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3-Acetyl-2-isopropyl-2H-furan-5-one
SpectraBase Compound ID dAM9kJdsFB
InChI InChI=1S/C9H12O3/c1-5(2)9-7(6(3)10)4-8(11)12-9/h4-5,9H,1-3H3
InChIKey SRHFTCJAHAWTIA-UHFFFAOYSA-N
Mol Weight 168.19 g/mol
Molecular Formula C9H12O3
Exact Mass 168.078644 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HU6ItNOJ7zm
Name 3-Acetyl-2-isopropyl-2H-furan-5-one
Alternate Name(s) 3-Acetyl-2-propan-2-yl-2H-furan-5-one 3-Ethanoyl-2-propan-2-yl-2H-furan-5-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H12O3
InChI InChI=1S/C9H12O3/c1-5(2)9-7(6(3)10)4-8(11)12-9/h4-5,9H,1-3H3
InChIKey SRHFTCJAHAWTIA-UHFFFAOYSA-N
Molecular Weight 168.192 g/mol
SMILES C=1(C(OC(C1)=O)C(C)C)C(=O)C
SPLASH splash10-00vi-3900000000-4e3ccf1cd16a8da9b004
Source of Spectrum AJ-67-2271-5
Wiley ID 772742