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SPICULISPORIC-ACID-C;(4S,5S)-4-(5-CARBOXYL-UNDECYL)-1-OXO-TETRAHYDROFURAN-4-CARBOXYL-ACID-METHYLESTER
SpectraBase Compound ID 7cFIkOQEmXo
InChI InChI=1S/C18H30O6/c1-3-4-5-6-7-8-9-10-11-14(16(20)21)18(17(22)23-2)13-12-15(19)24-18/h14H,3-13H2,1-2H3,(H,20,21)/t14-,18+/m1/s1
InChIKey MOQSEPITIGAHKF-KDOFPFPSSA-N
Mol Weight 342.43 g/mol
Molecular Formula C18H30O6
Exact Mass 342.204239 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9SK108dKTkm
Name SPICULISPORIC-ACID-C;(4S,5S)-4-(5-CARBOXYL-UNDECYL)-1-OXO-TETRAHYDROFURAN-4-CARBOXYL-ACID-METHYLESTER
Compound Number 2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C18H30O6
InChI InChI=1S/C18H30O6/c1-3-4-5-6-7-8-9-10-11-14(16(20)21)18(17(22)23-2)13-12-15(19)24-18/h14H,3-13H2,1-2H3,(H,20,21)/t14-,18+/m1/s1
InChIKey MOQSEPITIGAHKF-KDOFPFPSSA-N
Literature Reference Author R.WANG,T.M.LIU,M.H.SHEN,M.Q.YANG,Q.Y.FENG,X.M.TANG,X.M.LI
Literature Reference Citation MOLECULES,17,13175(2012)
Literature Reference DOI 10.3390/molecules171113175
Molecular Weight 342.433 g/mol
Sample ID 1589
Solvent CD3OD