John Wiley & Sons, Inc. SpectraBase; SpectraBase Compound ID=4N3aq4PDf8X SpectraBase Spectrum ID=2ByMPJySc85

(accessed ).
PULVERIC-ACID;3,11-DIOXOPFAFFAN-12-ENE-28-OIC-ACID
SpectraBase Compound ID 4N3aq4PDf8X
InChI InChI=1S/C29H40O4/c1-24(2)19-7-10-27(5)22(26(19,4)9-8-21(24)31)18(30)13-16-17-14-25(3)11-12-29(17,23(32)33)20(25)15-28(16,27)6/h13,17,19-20,22H,7-12,14-15H2,1-6H3,(H,32,33)/t17-,19+,20+,22-,25-,26+,27-,28-,29-/m1/s1
InChIKey OZBFJZOGHNTPKO-NFAQZRMJSA-N
Mol Weight 452.6 g/mol
Molecular Formula C29H40O4
Exact Mass 452.29266 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2ByMPJySc85
Name PULVERIC-ACID;3,11-DIOXOPFAFFAN-12-ENE-28-OIC-ACID
Compound Number 2
Copyright Copyright © 2016-2021 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C29H40O4
InChI InChI=1S/C29H40O4/c1-24(2)19-7-10-27(5)22(26(19,4)9-8-21(24)31)18(30)13-16-17-14-25(3)11-12-29(17,23(32)33)20(25)15-28(16,27)6/h13,17,19-20,22H,7-12,14-15H2,1-6H3,(H,32,33)/t17-,19+,20+,22-,25-,26+,27-,28-,29-/m1/s1
InChIKey OZBFJZOGHNTPKO-NFAQZRMJSA-N
Literature Reference Author Y.SHIOBARA,S.S.INOUE,Y.NISHIGUCHI,K.KATO,T.TAKEMOTO,N.NISHIM OTO,F.D.OLIVEIRA,G.A
Literature Reference Citation PHYTOCHEM.,31,1737(1992)
Literature Reference DOI 10.1016/0031-9422(92)83138-O
Molecular Weight 452.634 g/mol
Solvent C5D5N
Source File Reference UWVN6004
SpectraBase Batch ID AeUUKfW9EiI