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#SI-9;(2S,5S,6S,13S,9E)-5-[4-(4-FLUOROPHENYL)-PIPERAZIN-1-YLMETHYL]-5,13-DIHYDROXY-6,10-DIMETHYLTRICYCLO-[13.2.2.0(2,6)]-NONADECA-1(17),9,15,18-TETRAEN-17-YL-5

Compound with spectra: 1 NMR

#SI-9;(2S,5S,6S,13S,9E)-5-[4-(4-FLUOROPHENYL)-PIPERAZIN-1-YLMETHYL]-5,13-DIHYDROXY-6,10-DIMETHYLTRICYCLO-[13.2.2.0(2,6)]-NONADECA-1(17),9,15,18-TETRAEN-17-YL-5
SpectraBase Compound ID 609Jb7PA444
InChI InChI=1S/C38H47FN2O3S/c1-26-5-4-17-37(3)34(16-18-38(37,44)25-40-19-21-41(22-20-40)30-11-9-29(39)10-12-30)32-14-8-28(23-31(42)13-6-26)24-33(32)36(43)35-15-7-27(2)45-35/h5,7-12,14-15,24,31,34,42,44H,4,6,13,16-23,25H2,1-3H3/b26-5+/t31-,34-,37-,38+/m0/s1
InChIKey KEQOCTUVLOWTKH-FZSYOUKASA-N
Mol Weight 630.9 g/mol
Molecular Formula C38H47FN2O3S
Exact Mass 630.329143 g/mol
Enantiomer InChIKey KEQOCTUVLOWTKH-RSVFMAASSA-N

View Spectrum of #SI-9;(2S,5S,6S,13S,9E)-5-[4-(4-FLUOROPHENYL)-PIPERAZIN-1-YLMETHYL]-5,13-DIHYDROXY-6,10-DIMETHYLTRICYCLO-[13.2.2.0(2,6)]-NONADECA-1(17),9,15,18-TETRAEN-17-YL-5

13C NMR Spectrum
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent CDCl3
#SI-8;(2S,5S,6S,13S,9E)-5,13-DIHYDROXY-6,10-DIMETHYL-5-[5-(4-PYRIDYL)-1H-[1,2,4]-TRIAZOL-3-YLTHIOMETHYL]-TRICYCLO-[13.2.2.0(2,6)]-NONADECA-1(17),9,15,18-TETRAE
Benzo[f]isoindole-1,3-dione, 2,3,3a,4,9,9a-hexahydro-4,9-(1-oxoethano)-2-(2-pyridyl)-
2-(pyridin-2-yl)-3a,4,9,9a-tetrahydro-1H-4,9-ethanobenzo[f]isoindole-1,3,10(2H)-trione
2-(3-acetoacetyl-4-hydroxy-9,10-diketo-5,7-dimethoxy-2-anthryl)acetic acid tert-butyl ester
(R)-((1'S,4a'S,6'S,8a'S)-5',5',8a'-trimethyl-3',5-dioxo-3',4',4a',5',6',7',8',8a'-octahydro-2'H,5H-spiro[furan-2,1'-naphthalene]-6'-yl) 3,3,3-trifluoro-2-methoxy-2-phenylpropanoate
(S)-((1'S,4a'S,6'S,8a'S)-5',5',8a'-trimethyl-3',5-dioxo-3',4',4a',5',6',7',8',8a'-octahydro-2'H,5H-spiro[furan-2,1'-naphthalene]-6'-yl) 3,3,3-trifluoro-2-methoxy-2-phenylpropanoate
GOSSYPOL-SCHIFF-BASE;ENAMINE-ENAMINE-FORM
QTQHGSDZRGLSFL-IAGOWNOFSA-N
1.alpha.-(Angeloyloxy)-6.beta.-hydroxy-8.beta.-methoxy-10.beta.H-eremophil-7(11)-en-8.alpha.,12-olide
(E)-(4S,4aR,5S,8S,8aR,9aS)-4-hydroxy-9a-methoxy-3,4a,5-trimethyl-2-oxo-2,4,4a,5,6,7,8,8a,9,9a-decahydronaphtho[2,3-b]furan-8-yl 2-methylbut-2-enoate
Title Journal or Book Year
Small-Molecule Diversity Using a Skeletal Transformation Strategy Organic Letters 2005
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