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Petuniolide A

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Petuniolide A
SpectraBase Compound ID CqnQYgbVWfd
InChI InChI=1S/C31H44O8/c1-15(21-14-28(6)27(4,5)38-30(8,36-21)39-28)19-9-10-20-24-18(13-22(29(19,20)7)34-17(3)32)16(2)31(26-25(24)35-26)12-11-23(33)37-31/h13,15-16,19-22,24-26H,9-12,14H2,1-8H3
InChIKey JFZWPMXWDBVHDW-UHFFFAOYSA-N
Mol Weight 544.7 g/mol
Molecular Formula C31H44O8
Exact Mass 544.303618 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HXhPWB9n5IF
Name Petuniolide A
Comments NICOLET NT-200 SPECTROMETER
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C31H44O8
InChI InChI=1S/C31H44O8/c1-15(21-14-28(6)27(4,5)38-30(8,36-21)39-28)19-9-10-20-24-18(13-22(29(19,20)7)34-17(3)32)16(2)31(26-25(24)35-26)12-11-23(33)37-31/h13,15-16,19-22,24-26H,9-12,14H2,1-8H3
InChIKey JFZWPMXWDBVHDW-UHFFFAOYSA-N
Instrument Name see comment
Literature Reference C.A. Elliger, R.Y. Wong, A.C.Waiss, J. Chem. Soc. Perkin I 525 (1990).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3