For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
2-[(3,4-METHYLENEDIOXYPHENYL)-DODECYL]-4-HYDROXY-2,3,4,6,7,8-HEXAHYDRO-2-H-1-BENZOPYRAN-5-ONE
SpectraBase Compound ID 52xrotdwZWX
InChI InChI=1S/C28H40O5/c29-23-14-11-15-26-28(23)24(30)19-22(33-26)13-10-8-6-4-2-1-3-5-7-9-12-21-16-17-25-27(18-21)32-20-31-25/h16-18,22,24,30H,1-15,19-20H2/t22-,24+/m0/s1
InChIKey YHJGSFFBACPLMU-LADGPHEKSA-N
Mol Weight 456.6 g/mol
Molecular Formula C28H40O5
Exact Mass 456.287574 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID IiwqPufayDX
Name 2-[(3,4-METHYLENEDIOXYPHENYL)-DODECYL]-4-HYDROXY-2,3,4,6,7,8-HEXAHYDRO-2-H-1-BENZOPYRAN-5-ONE
Compound Number 4
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C28H40O5
InChI InChI=1S/C28H40O5/c29-23-14-11-15-26-28(23)24(30)19-22(33-26)13-10-8-6-4-2-1-3-5-7-9-12-21-16-17-25-27(18-21)32-20-31-25/h16-18,22,24,30H,1-15,19-20H2/t22-,24+/m0/s1
InChIKey YHJGSFFBACPLMU-LADGPHEKSA-N
Literature Reference Author N.LI,J.L.WU,T.HASEGAWA,J.I.SASAKI,L.M.BAI,L.Y.WANG,S.KAKUTA, Y.FURUYA,H.OGURA,T.K
Literature Reference Citation J.NAT.PROD.,70,998(2007)
Literature Reference DOI 10.1021/np070089n
Molecular Weight 456.623 g/mol
Sample ID 30520
Solvent CDCl3