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3,5,5-Trimethyl-2(5H)-furanone
SpectraBase Compound ID Jabvuzt6cCC
InChI InChI=1S/C7H10O2/c1-5-4-7(2,3)9-6(5)8/h4H,1-3H3
InChIKey OAVLYQLCBORARJ-UHFFFAOYSA-N
Mol Weight 126.15 g/mol
Molecular Formula C7H10O2
Exact Mass 126.06808 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6I6Ihb8eaWM
Name 3,5,5-Trimethyl-2(5H)-furanone
Alternate Name(s) 2(5H)-Furanone, 3,5,5-trimethyl- 2,4,4-Trimethyl-2-butenolide 3,5,5-trimethyl-2-furanone 3,5,5-trimethylfuran-2-one
CAS Registry Number 50598-50-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H10O2
InChI InChI=1S/C7H10O2/c1-5-4-7(2,3)9-6(5)8/h4H,1-3H3
InChIKey OAVLYQLCBORARJ-UHFFFAOYSA-N
Molecular Weight 126.155 g/mol
SMILES C1(C=C(C(O1)=O)C)(C)C
SPLASH splash10-0006-9200000000-ede7c42f830209cfb027
Source of Spectrum KI-0-6-0
Wiley ID 1129863