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1-(2-Methylpropanoyl)-3-oxabicyclo[3.1.0]hexan-2-one
SpectraBase Compound ID Fvivr4FpW40
InChI InChI=1S/C9H12O3/c1-5(2)7(10)9-3-6(9)4-12-8(9)11/h5-6H,3-4H2,1-2H3
InChIKey RKXVEGXHNVBDFB-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 AER1Ps528YA
Name 1-(2-Methylpropanoyl)-3-oxabicyclo[3.1.0]hexan-2-one
Alternate Name(s) Salinilactone E
Appearance Yellow liquid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H12O3
InChI InChI=1S/C9H12O3/c1-5(2)7(10)9-3-6(9)4-12-8(9)11/h5-6H,3-4H2,1-2H3
InChIKey RKXVEGXHNVBDFB-UHFFFAOYSA-N
Instrument Name HP 6890-5973 or Agilent 7890B-5977A
Ionization Type EI
Literature Reference DOI 10.1002/cbic.201900764
Molecular Weight 168.192 g/mol
SMILES C12(C(OCC1C2)=O)C(C(C)C)=O
SPLASH splash10-0fiu-9600000000-3b0036ebc9cba51b3d0b
Source of Spectrum CBC-21-1630-1e
Wiley ID 1855974