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#45B;(+)-(2S,2AR,4AS,6S,7BS)-6-[(1R)-(2-DIPHENYLCYCLOPENTYL)-OXY]-3-OXOOCTAHYDRO-1,4,7-TRIOXA-7A-AZABICYCLOPENT-[CD]-INDENE-2-CARBOXYLIC-ACID-1-METHYLETHYLESTE

View entire compound with spectra: 1 NMR

#45B;(+)-(2S,2AR,4AS,6S,7BS)-6-[(1R)-(2-DIPHENYLCYCLOPENTYL)-OXY]-3-OXOOCTAHYDRO-1,4,7-TRIOXA-7A-AZABICYCLOPENT-[CD]-INDENE-2-CARBOXYLIC-ACID-1-METHYLETHYLESTE
SpectraBase Compound ID 66an693aBTZ
InChI InChI=1S/C28H31NO7/c1-17(2)32-27(31)25-23-24-20(33-26(23)30)16-22(35-29(24)36-25)34-21-14-9-15-28(21,18-10-5-3-6-11-18)19-12-7-4-8-13-19/h3-8,10-13,17,20-25H,9,14-16H2,1-2H3/t20-,21+,22-,23-,24-,25-/m0/s1
InChIKey HFLMIWYIHSNTII-INZDBNIQSA-N
Mol Weight 493.56 g/mol
Molecular Formula C28H31NO7
Exact Mass 493.210052 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7CNSynA56ZE
Name #45B;(+)-(2S,2AR,4AS,6S,7BS)-6-[(1R)-(2-DIPHENYLCYCLOPENTYL)-OXY]-3-OXOOCTAHYDRO-1,4,7-TRIOXA-7A-AZABICYCLOPENT-[CD]-INDENE-2-CARBOXYLIC-ACID-1-METHYLETHYLESTE
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C28H31NO7
InChI InChI=1S/C28H31NO7/c1-17(2)32-27(31)25-23-24-20(33-26(23)30)16-22(35-29(24)36-25)34-21-14-9-15-28(21,18-10-5-3-6-11-18)19-12-7-4-8-13-19/h3-8,10-13,17,20-25H,9,14-16H2,1-2H3/t20-,21+,22-,23-,24-,25-/m0/s1
InChIKey HFLMIWYIHSNTII-INZDBNIQSA-N
Literature Reference Author S.E.DENMARK,A.THORARENSEN,D.S.MIDDLETON
Literature Reference Citation J.AM.CHEM.SOC.,118,8266(1996)
Literature Reference DOI 10.1021/ja961630x
Molecular Weight 493.557 g/mol
Sample ID 45900
Solvent CDCl3