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Dihydro-trans-iso-humulone

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Dihydro-trans-iso-humulone
SpectraBase Compound ID 5aM14cSLYTk
InChI InChI=1S/C21H32O5/c1-12(2)7-9-15-19(24)18(16(22)11-14(5)6)20(25)21(15,26)17(23)10-8-13(3)4/h8,12,14-15,25-26H,7,9-11H2,1-6H3
InChIKey NXILLPXMJHFJNC-UHFFFAOYSA-N
Mol Weight 364.5 g/mol
Molecular Formula C21H32O5
Exact Mass 364.224974 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID EJ9T4iY5P6b
Name Dihydro-trans-iso-humulone
CAS Registry Number 58461-25-9
Comments RESONANCES OF C1, C3 AND C16 ADDED
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C21H32O5
InChI InChI=1S/C21H32O5/c1-12(2)7-9-15-19(24)18(16(22)11-14(5)6)20(25)21(15,26)17(23)10-8-13(3)4/h8,12,14-15,25-26H,7,9-11H2,1-6H3
InChIKey NXILLPXMJHFJNC-UHFFFAOYSA-N
Instrument Name Varian XL-100
Literature Reference F. Borremans, M. Depotter, Org. Magn. Resonance 7, 415 (1975).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CCl4