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6-Isobutyryl-1,4-dioxaspiro[4.6]undecane
SpectraBase Compound ID DKwnb0jE6Xk
InChI InChI=1S/C13H22O3/c1-10(2)12(14)11-6-4-3-5-7-13(11)15-8-9-16-13/h10-11H,3-9H2,1-2H3
InChIKey KYMODVZJGIOZJG-UHFFFAOYSA-N
Mol Weight 226.32 g/mol
Molecular Formula C13H22O3
Exact Mass 226.156895 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BNgWYTlhC1l
Name 6-Isobutyryl-1,4-dioxaspiro[4.6]undecane
Alternate Name(s) 1-(1,4-dioxaspiro[4.6]undec-6-yl)-2-methyl-1-propanone
CAS Registry Number 64425-46-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H22O3
InChI InChI=1S/C13H22O3/c1-10(2)12(14)11-6-4-3-5-7-13(11)15-8-9-16-13/h10-11H,3-9H2,1-2H3
InChIKey KYMODVZJGIOZJG-UHFFFAOYSA-N
Molecular Weight 226.316 g/mol
SMILES C1(C2(OCCO2)CCCCC1)C(=O)C(C)C
SPLASH splash10-000w-9300000000-8422255cfa0643a43c16
Source of Spectrum J-43-608-0
Wiley ID 1227552