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AJUGARIN-I-CHLOROHYDRIN

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AJUGARIN-I-CHLOROHYDRIN
SpectraBase Compound ID Dx9PXQXe6ob
InChI InChI=1S/C24H35ClO7/c1-15-10-20(32-17(3)27)24(14-31-16(2)26)19(6-5-8-23(24,29)13-25)22(15,4)9-7-18-11-21(28)30-12-18/h11,15,19-20,29H,5-10,12-14H2,1-4H3/t15-,19-,20+,22+,23+,24+/m1/s1
InChIKey LUBDISRPOXFANL-PGQNDPHJSA-N
Mol Weight 471.0 g/mol
Molecular Formula C24H35ClO7
Exact Mass 470.207131 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID EJIAKChr81o
Name AJUGARIN-I-CHLOROHYDRIN
Compound Number 4
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C24H35ClO7
InChI InChI=1S/C24H35ClO7/c1-15-10-20(32-17(3)27)24(14-31-16(2)26)19(6-5-8-23(24,29)13-25)22(15,4)9-7-18-11-21(28)30-12-18/h11,15,19-20,29H,5-10,12-14H2,1-4H3/t15-,19-,20+,22+,23+,24+/m1/s1
InChIKey LUBDISRPOXFANL-PGQNDPHJSA-N
Literature Reference Author P.S.BEAUCHAMP,A.T.BOTTINI,M.C.CASELLES,V.DEV,H.HOPE,M.LARTER ,G.LEE,C.S.MATHELA,A
Literature Reference Citation PHYTOCHEM.,43,827(1996)
Literature Reference DOI 10.1016/0031-9422(96)00207-5
Molecular Weight 470.991 g/mol
Solvent CDCl3
Source File Reference UWMS2195