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2-methyl-3-(3-oxidanylpropoxy)pyran-4-one
SpectraBase Compound ID 1Cq8ruCBB5t
InChI InChI=1S/C9H12O4/c1-7-9(13-5-2-4-10)8(11)3-6-12-7/h3,6,10H,2,4-5H2,1H3
InChIKey IEPGPSMYRSFOSV-UHFFFAOYSA-N
Mol Weight 184.19 g/mol
Molecular Formula C9H12O4
Exact Mass 184.073559 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KQ9TJ5cY0SF
Name 2-methyl-3-(3-oxidanylpropoxy)pyran-4-one
Alternate Name(s) 3-(3-hydroxypropoxy)-2-methyl-4-pyranone 3-(3-hydroxypropoxy)-2-methyl-pyran-4-one
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H12O4
InChI InChI=1S/C9H12O4/c1-7-9(13-5-2-4-10)8(11)3-6-12-7/h3,6,10H,2,4-5H2,1H3
InChIKey IEPGPSMYRSFOSV-UHFFFAOYSA-N
Molecular Weight 184.191 g/mol
SMILES OCCCOC1=C(OC=CC1=O)C
SPLASH splash10-004i-0900000000-9bca9da8eabfcc623bab
Source of Spectrum KC-0-452-10
Wiley ID 821009