John Wiley & Sons, Inc. SpectraBase; SpectraBase Compound ID=7RpY4ew19qr SpectraBase Spectrum ID=2966pINrbms

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SECOLOGANIN_DIMETHYLACETAL
SpectraBase Compound ID 7RpY4ew19qr
InChI InChI=1S/C19H30O11/c1-5-9-10(6-13(25-2)26-3)11(17(24)27-4)8-28-18(9)30-19-16(23)15(22)14(21)12(7-20)29-19/h5,8-10,12-16,18-23H,1,6-7H2,2-4H3/t9-,10+,12+,14+,15-,16+,18+,19-/m1/s1
InChIKey HUVIXLWRQSMCLN-FSUGKLMFSA-N
Mol Weight 434.44 g/mol
Molecular Formula C19H30O11
Exact Mass 434.178812 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2966pINrbms
Name SECOLOGANIN-DIMETHYLACETAL
Compound Number 113
Copyright Copyright © 2016-2021 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C19H30O11
InChI InChI=1S/C19H30O11/c1-5-9-10(6-13(25-2)26-3)11(17(24)27-4)8-28-18(9)30-19-16(23)15(22)14(21)12(7-20)29-19/h5,8-10,12-16,18-23H,1,6-7H2,2-4H3/t9-,10+,12+,14+,15-,16+,18+,19-/m1/s1
InChIKey HUVIXLWRQSMCLN-FSUGKLMFSA-N
Literature Reference Author C.A.BOROS,F.R.STERMITZ
Literature Reference Citation J.NAT.PROD.,54,1173(1991)
Literature Reference DOI 10.1021/np50077a001
Molecular Weight 434.441 g/mol
Solvent PYRIDINE-D5
Source File Reference UWCS4474
SpectraBase Batch ID BIdqKMcCMKQ