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METHYL-(2AR*,10BS*,10CR*)-2A-HYDROXY-5-OXO-1,2,2A,4,5,10C-HEXAHYDROBENZO-[B]-PENTACYCLO-[HI]-INDOLE-10B-(3H)-CARBOXYLATE
SpectraBase Compound ID HszwxzXR5oK
InChI InChI=1S/C16H17NO4/c1-21-14(19)16-9-8-15(20)7-6-12(18)17(13(15)16)11-5-3-2-4-10(11)16/h2-5,13,20H,6-9H2,1H3/t13-,15+,16+/m0/s1
InChIKey WBFQANLGJOQPQU-NUEKZKHPSA-N
Mol Weight 287.31 g/mol
Molecular Formula C16H17NO4
Exact Mass 287.115758 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LMgqVDgOPdH
Name METHYL-(2AR*,10BS*,10CR*)-2A-HYDROXY-5-OXO-1,2,2A,4,5,10C-HEXAHYDROBENZO-[B]-PENTACYCLO-[HI]-INDOLE-10B-(3H)-CARBOXYLATE
Compound Number 22
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C16H17NO4
InChI InChI=1S/C16H17NO4/c1-21-14(19)16-9-8-15(20)7-6-12(18)17(13(15)16)11-5-3-2-4-10(11)16/h2-5,13,20H,6-9H2,1H3/t13-,15+,16+/m0/s1
InChIKey WBFQANLGJOQPQU-NUEKZKHPSA-N
Literature Reference Author S.GROSS,H.U.REISSIG
Literature Reference Citation ORG.LETTERS,5,4305(2003)
Literature Reference DOI 10.1021/ol0355581
Molecular Weight 287.315 g/mol
Sample ID 38827
Solvent CDCl3