John Wiley & Sons, Inc. SpectraBase; SpectraBase Compound ID=4AT2qo5MY1z SpectraBase Spectrum ID=2C1cm9AGK4v

(accessed ).
BAUFQYWNOBPCAK-BMHHCVKDSA-N
SpectraBase Compound ID 4AT2qo5MY1z
InChI InChI=1S/C28H35ClO4/c1-15-12-23(33-26(31)16(15)2)17(3)18-7-9-20-19(13-18)8-10-22-21(20)14-24(29)28(32)11-5-6-25(30)27(22,28)4/h7,9,13,17,21-24,32H,5-6,8,10-12,14H2,1-4H3/t17-,21?,22?,23?,24+,27-,28-/m0/s1
InChIKey BAUFQYWNOBPCAK-BMHHCVKDSA-N
Mol Weight 471.0 g/mol
Molecular Formula C28H35ClO4
Exact Mass 470.222388 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2C1cm9AGK4v
Name BAUFQYWNOBPCAK-BMHHCVKDSA-N
Compound Number 5
Copyright Copyright © 2016-2021 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C28H35ClO4
InChI InChI=1S/C28H35ClO4/c1-15-12-23(33-26(31)16(15)2)17(3)18-7-9-20-19(13-18)8-10-22-21(20)14-24(29)28(32)11-5-6-25(30)27(22,28)4/h7,9,13,17,21-24,32H,5-6,8,10-12,14H2,1-4H3/t17-,21?,22?,23?,24+,27-,28-/m0/s1
InChIKey BAUFQYWNOBPCAK-BMHHCVKDSA-N
Literature Reference Author A.S.VELEIRO,J.C.OBERTI,G.BURTON
Literature Reference Citation PHYTOCHEM.,31,935(1992)
Literature Reference DOI 10.1016/0031-9422(92)80042-d
Molecular Weight 471.037 g/mol
Solvent Unknown
Source File Reference UWVN4968
SpectraBase Batch ID F7A1tnwsQTC