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cis, cis-4-Formyl-(3,5-dioxa-hexyl)-3-(benzyl-carbamato)-cyclohexene

View entire compound with spectra: 2 NMR

cis, cis-4-Formyl-(3,5-dioxa-hexyl)-3-(benzyl-carbamato)-cyclohexene
SpectraBase Compound ID LesltG1gIfS
InChI InChI=1S/C19H25NO5/c1-23-14-24-11-10-16-8-5-9-18(17(16)12-21)20-19(22)25-13-15-6-3-2-4-7-15/h2-7,9,12,16-18H,8,10-11,13-14H2,1H3,(H,20,22)
InChIKey ZNDCTBIIDAWPAJ-UHFFFAOYSA-N
Mol Weight 347.41 g/mol
Molecular Formula C19H25NO5
Exact Mass 347.173273 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2sMjBMZDIU3
Name trans, trans-4-Formyl-(3,5-dioxa-hexyl)-3-(benzyl-carbamato)-cyclohexene
CAS Registry Number 86258-56-2
Copyright Copyright © 2002-2025 Wiley-VCH GmbH. All Rights Reserved.
Formula C19H25NO5
InChI InChI=1S/C19H25NO5/c1-23-14-24-11-10-16-8-5-9-18(17(16)12-21)20-19(22)25-13-15-6-3-2-4-7-15/h2-7,9,12,16-18H,8,10-11,13-14H2,1H3,(H,20,22)
InChIKey ZNDCTBIIDAWPAJ-UHFFFAOYSA-N
Instrument Name Bruker WM-250
Literature Reference L.E. Overman, D. Lesuisse, M. Hashimoto, J. Am. Chem. Soc. 105, 5373 (1983).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3