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Spiro[4.5]dec-7-ene-1-butanoic acid, 9-hydroxy-8-(methoxycarbonyl)-.gamma.,4-dimethyl-, methyl ester, [1R-[1.alpha.(R*),4.beta.,5.beta.(S*)]]-
SpectraBase Compound ID AjCk5WtWYg0
InChI InChI=1S/C19H30O5/c1-12(5-8-17(21)23-3)15-7-6-13(2)19(15)10-9-14(16(20)11-19)18(22)24-4/h9,12-13,15-16,20H,5-8,10-11H2,1-4H3/t12?,13-,15+,16+,19-/m0/s1
InChIKey LXKYUWZFAOUNNC-LBZCZRLSSA-N
Mol Weight 338.44 g/mol
Molecular Formula C19H30O5
Exact Mass 338.209324 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1vafw7LezBw
Name Spiro[4.5]dec-7-ene-1-butanoic acid, 9-hydroxy-8-(methoxycarbonyl)-.gamma.,4-dimethyl-, methyl ester, [1R-[1.alpha.(R*),4.beta.,5.beta.(S*)]]-
Alternate Name(s) Dimethyl ester of trisnoracorane isoprenologue diacid Methyl (1R,4S,5S,9R)-9-hydroxy-1-(4-methoxy-1-methyl-4-oxobutyl)-4-methylspiro[4.5]dec-7-ene-8-carboxylate
CAS Registry Number 90363-75-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H30O5
InChI InChI=1S/C19H30O5/c1-12(5-8-17(21)23-3)15-7-6-13(2)19(15)10-9-14(16(20)11-19)18(22)24-4/h9,12-13,15-16,20H,5-8,10-11H2,1-4H3/t12?,13-,15+,16+,19-/m0/s1
InChIKey LXKYUWZFAOUNNC-LBZCZRLSSA-N
Molecular Weight 338.444 g/mol
SMILES O[C@@]1(C[C@@]2([C@](CC[C@@]2(C)[H])(C(CCC(=O)OC)C)[H])CC=C1C(=O)OC)[H]
SPLASH splash10-01p2-0960000000-f796fd6942883ee461aa
Source of Spectrum B-37-642-0
Wiley ID 1333778