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2,2-Dimethyl-3-oxo-3,4-dihydro-2H-benzo[b][1,4]dioxepin-7-carbaldehyde
SpectraBase Compound ID BKwiXWEuOoP
InChI InChI=1S/C12H12O4/c1-12(2)11(14)7-15-10-5-8(6-13)3-4-9(10)16-12/h3-6H,7H2,1-2H3
InChIKey UVGSGGUOUXSIPZ-UHFFFAOYSA-N
Mol Weight 220.22 g/mol
Molecular Formula C12H12O4
Exact Mass 220.073559 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AHSFLu0t5E0
Name 2,2-Dimethyl-3-oxo-3,4-dihydro-2H-benzo[b][1,4]dioxepin-7-carbaldehyde
Alternate Name(s) 2,2-Dimethyl-3-oxo-3,4-dihydro-2H-1,5-benzodioxepin-7-carbaldehyde
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H12O4
InChI InChI=1S/C12H12O4/c1-12(2)11(14)7-15-10-5-8(6-13)3-4-9(10)16-12/h3-6H,7H2,1-2H3
InChIKey UVGSGGUOUXSIPZ-UHFFFAOYSA-N
Molecular Weight 220.224 g/mol
SMILES C1(Oc2c(OCC1=O)cc(cc2)C=O)(C)C
SPLASH splash10-0002-1920000000-4c4a55216f62a72a1485
Source of Spectrum F-55-10114-11
Wiley ID 838899