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DEHYDROSULPHURENIC-ACID
SpectraBase Compound ID 4jXhr8yxj2Q
InChI InChI=1S/C31H48O4/c1-18(2)19(3)9-10-20(27(34)35)23-17-26(33)31(8)22-11-12-24-28(4,5)25(32)14-15-29(24,6)21(22)13-16-30(23,31)7/h11,13,18,20,23-26,32-33H,3,9-10,12,14-17H2,1-2,4-8H3,(H,34,35)/t20-,23?,24?,25-,26-,29+,30+,31+/m0/s1
InChIKey DGVHJZPQGFRVEC-JRJYJQBVSA-N
Mol Weight 484.7 g/mol
Molecular Formula C31H48O4
Exact Mass 484.35526 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KX9layrLQLd
Name DEHYDROSULPHURENIC-ACID
Compound Number 8
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C31H48O4
InChI InChI=1S/C31H48O4/c1-18(2)19(3)9-10-20(27(34)35)23-17-26(33)31(8)22-11-12-24-28(4,5)25(32)14-15-29(24,6)21(22)13-16-30(23,31)7/h11,13,18,20,23-26,32-33H,3,9-10,12,14-17H2,1-2,4-8H3,(H,34,35)/t20-,23?,24?,25-,26-,29+,30+,31+/m0/s1
InChIKey DGVHJZPQGFRVEC-JRJYJQBVSA-N
Literature Reference Author S.W.YANG,Y.C.SHEN,C.H.CHEN
Literature Reference Citation PHYTOCHEM.,41,1389(1996)
Literature Reference DOI 10.1016/0031-9422(95)00767-9
Molecular Weight 484.720 g/mol
Solvent C5D5N
Source File Reference UWLU4411