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13-Apo.beta.-caroten-13-one

View entire compound with spectra: 2 NMR, and 1 MS (GC)

13-Apo.beta.-caroten-13-one
SpectraBase Compound ID 8gDdJLmmBKl
InChI InChI=1S/C18H26O/c1-14(8-6-10-16(3)19)11-12-17-15(2)9-7-13-18(17,4)5/h6,8,10-12H,7,9,13H2,1-5H3/b10-6+,12-11+,14-8+
InChIKey UBTNVRPIHJRBCI-LUXGDSJYSA-N
Mol Weight 258.4 g/mol
Molecular Formula C18H26O
Exact Mass 258.198365 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DAmXTA6jiez
Name 13-Apo.beta.-caroten-13-one
CAS Registry Number 1220-77-5
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C18H26O
InChI InChI=1S/C18H26O/c1-14(8-6-10-16(3)19)11-12-17-15(2)9-7-13-18(17,4)5/h6,8,10-12H,7,9,13H2,1-5H3/b10-6+,12-11+,14-8+
InChIKey UBTNVRPIHJRBCI-LUXGDSJYSA-N
Instrument Name Bruker WH-90
Literature Reference W. Bremser, J. Paust, Org. Magn. Resonance 6, 433 (1974).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3