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7-ACETYL-[6-HYDROXY-2-(4-HYDROXYPHENYL)-1-BENZOTHIOPHEN-3-YL]-[4-[2-(PIPERIDIN-1-YL)-ETHOXY]-PHENYL]-METHANONE;7-MARLF;IMPURITY-8
SpectraBase Compound ID 6su6VvrpHpY
InChI InChI=1S/C30H29NO5S/c1-19(32)26-25(34)14-13-24-27(29(37-30(24)26)21-5-9-22(33)10-6-21)28(35)20-7-11-23(12-8-20)36-18-17-31-15-3-2-4-16-31/h5-14,33-34H,2-4,15-18H2,1H3
InChIKey BOCZPYQONWFZLC-UHFFFAOYSA-N
Mol Weight 515.62 g/mol
Molecular Formula C30H29NO5S
Exact Mass 515.176644 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HZTGYUPlVHF
Name 7-ACETYL-[6-HYDROXY-2-(4-HYDROXYPHENYL)-1-BENZOTHIOPHEN-3-YL]-[4-[2-(PIPERIDIN-1-YL)-ETHOXY]-PHENYL]-METHANONE;7-MARLF;IMPURITY-8
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C30H29NO5S
InChI InChI=1S/C30H29NO5S/c1-19(32)26-25(34)14-13-24-27(29(37-30(24)26)21-5-9-22(33)10-6-21)28(35)20-7-11-23(12-8-20)36-18-17-31-15-3-2-4-16-31/h5-14,33-34H,2-4,15-18H2,1H3
InChIKey BOCZPYQONWFZLC-UHFFFAOYSA-N
Literature Reference Author R.B.REDDY,T.V.GOUD,N.NAGAMANI,N.P.KUMAR,A.ALAGUDURAI,R.MURUG AN,K.PARTHASARATHY,V
Literature Reference Citation SCI.PHARM.,80,605(2012)
Literature Reference DOI 10.3797/scipharm.1204-13
Molecular Weight 515.624 g/mol
Sample ID 73515
Solvent Unknown