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1,3-Dioxepane-5-carboxaldehyde, 2-(1-methylethyl)-
SpectraBase Compound ID JluSIFFbxuy
InChI InChI=1S/C9H16O3/c1-7(2)9-11-4-3-8(5-10)6-12-9/h5,7-9H,3-4,6H2,1-2H3
InChIKey QLCSCWQWEDTIQK-UHFFFAOYSA-N
Mol Weight 172.22 g/mol
Molecular Formula C9H16O3
Exact Mass 172.109944 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 96amznSTAPE
Name 1,3-Dioxepane-5-carboxaldehyde, 2-(1-methylethyl)-
CAS Registry Number 109991-74-4
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C9H16O3
InChI InChI=1S/C9H16O3/c1-7(2)9-11-4-3-8(5-10)6-12-9/h5,7-9H,3-4,6H2,1-2H3
InChIKey QLCSCWQWEDTIQK-UHFFFAOYSA-N
Instrument Name Bruker AM-270
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3