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ONCHITRIOL-#2
SpectraBase Compound ID LSRWKwdhJWB
InChI InChI=1S/C32H48O7/c1-12-24(33)17(5)31-23(11)29(37)20(8)30(39-31)16(4)14-15(3)26(34)19(7)28(36)22(10)32-21(9)27(35)18(6)25(13-2)38-32/h14,16-17,19,22,24,26,28,33-34,36H,12-13H2,1-11H3/b15-14+/t16-,17+,19+,22-,24+,26-,28-/m0/s1
InChIKey HLJUWPYOKLNZAF-ZYWQUJIISA-N
Mol Weight 544.7 g/mol
Molecular Formula C32H48O7
Exact Mass 544.340004 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9EuLFpPPYHm
Name ONCHITRIOL-#2
CAS Registry Number 140924-48-7
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C32H48O7
InChI InChI=1S/C32H48O7/c1-12-24(33)17(5)31-23(11)29(37)20(8)30(39-31)16(4)14-15(3)26(34)19(7)28(36)22(10)32-21(9)27(35)18(6)25(13-2)38-32/h14,16-17,19,22,24,26,28,33-34,36H,12-13H2,1-11H3/b15-14+/t16-,17+,19+,22-,24+,26-,28-/m0/s1
InChIKey HLJUWPYOKLNZAF-ZYWQUJIISA-N
Literature Reference Author J.RODRIGUEZ,R.RIGUERA,C.DEBITUS
Literature Reference Citation J.ORG.CHEM.,57,4624(1992)
Literature Reference DOI 10.1021/jo00043a018
Molecular Weight 544.729 g/mol
Solvent CDCl3
Source File Reference UWCS2474