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(1S,2S,3S,4R,6S,7S,8R,12S)-3,7-DIBENZYLOXY-6-(3-BUTENYL)-4,6-(DICYCLOHEXYLSILYLENEDIOXY)-2,12-(ISOPROPYLIDENEDIOXY)-1,5,5-TRIMETHYL-9-METHYLENEBI
SpectraBase Compound ID 1QqJAz4tvRa
InChI InChI=1S/C49H70O6Si/c1-8-9-32-49-43(51-34-37-24-16-11-17-25-37)41-35(2)30-31-40-48(41,7)45(53-47(5,6)52-40)42(50-33-36-22-14-10-15-23-36)44(46(49,3)4)54-56(55-49,38-26-18-12-19-27-38)39-28-20-13-21-29-39/h8,10-11,14-17,22-25,38-45H,1-2,9,12-13,18-21,26-34H2,3-7H3/t40-,41?,42+,43?,44-,45+,48+,49+/m0/s1
InChIKey MQTUXZKMZIZUQY-KALMPTTCSA-N
Mol Weight 783.2 g/mol
Molecular Formula C49H70O6Si
Exact Mass 782.494167 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID GohI2QOb024
Name (1S,2S,3S,4R,6S,7S,8R,12S)-3,7-DIBENZYLOXY-6-(3-BUTENYL)-4,6-(DICYCLOHEXYLSILYLENEDIOXY)-2,12-(ISOPROPYLIDENEDIOXY)-1,5,5-TRIMETHYL-9-METHYLENEBI
Compound Number 52B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C49H70O6Si
InChI InChI=1S/C49H70O6Si/c1-8-9-32-49-43(51-34-37-24-16-11-17-25-37)41-35(2)30-31-40-48(41,7)45(53-47(5,6)52-40)42(50-33-36-22-14-10-15-23-36)44(46(49,3)4)54-56(55-49,38-26-18-12-19-27-38)39-28-20-13-21-29-39/h8,10-11,14-17,22-25,38-45H,1-2,9,12-13,18-21,26-34H2,3-7H3/t40-,41?,42+,43?,44-,45+,48+,49+/m0/s1
InChIKey MQTUXZKMZIZUQY-KALMPTTCSA-N
Literature Reference Author T.MUKAIYAMA,I.SHIINA,H.IWADARE,M.SAITOH,T.NISHIMURA,N.OHKAWA ,H.SAKOH,K.NISHIMURA
Literature Reference Citation CHEM.EUR.J.,5,121(1999)
Literature Reference DOI 10.1002/(sici)1521-3765(19990104)5:1<121::aid-chem121>3.3.co;2-f
Molecular Weight 783.177 g/mol
Solvent C6D6
Source File Reference UWRU9500