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CIS-5-[(4-TERT.-BUTYLPHENYL)-AMINO]-HEXAHYDRO-3-HYDROXYTHIEPINE
SpectraBase Compound ID FTduufDtrSt
InChI InChI=1S/C16H25NOS/c1-16(2,3)12-4-6-13(7-5-12)17-14-8-9-19-11-15(18)10-14/h4-7,14-15,17-18H,8-11H2,1-3H3/t14-,15-/m0/s1
InChIKey KANRNTBVRWAJLA-GJZGRUSLSA-N
Mol Weight 279.44 g/mol
Molecular Formula C16H25NOS
Exact Mass 279.165686 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID H3bRytUncyr
Name CIS-5-[(4-TERT.-BUTYLPHENYL)-AMINO]-HEXAHYDRO-3-HYDROXYTHIEPINE
CAS Registry Number 127355-77-5
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C16H25NOS
InChI InChI=1S/C16H25NOS/c1-16(2,3)12-4-6-13(7-5-12)17-14-8-9-19-11-15(18)10-14/h4-7,14-15,17-18H,8-11H2,1-3H3/t14-,15-/m0/s1
InChIKey KANRNTBVRWAJLA-GJZGRUSLSA-N
Literature Reference Author H.G.AURICH,M.BOUTAHAR,H.KOESTER,K.D.MOEBUS,L.RUIZ
Literature Reference Citation CHEM.BER.,123,1999(1990)
Literature Reference DOI 10.1002/cber.19901231011
Molecular Weight 279.441 g/mol
Solvent CDCl3
Source File Reference UWED10357