(3aR,4aR,10bR)-2-Tosyl-1,2,3,3a,4,4a-hexahydropyrrolo[3',4':2,3]cyclobuta[1,2-c]quinol-5(6H)-one

SpectraBase Compound ID	L1bk4HLrBRj
InChI	InChI=1S/C20H20N2O3S/c1-13-6-8-15(9-7-13)26(24,25)22-11-14-10-17-19(23)21-18-5-3-2-4-16(18)20(14,17)12-22/h2-9,14,17H,10-12H2,1H3,(H,21,23)/t14-,17-,20+/m0/s1
InChIKey	DQMKJEKBPCCZLS-GZRFBZBPSA-N Google Search
Mol Weight	368.45 g/mol
Molecular Formula	C20H20N2O3S
Exact Mass	368.119464 g/mol

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SpectraBase Spectrum ID	J6yZNB1sxKI
Name	(3aR,4aR,10bR)-2-Tosyl-1,2,3,3a,4,4a-hexahydropyrrolo[3',4':2,3]cyclobuta[1,2-c]quinol-5(6H)-one
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C20H20N2O3S
InChI	InChI=1S/C20H20N2O3S/c1-13-6-8-15(9-7-13)26(24,25)22-11-14-10-17-19(23)21-18-5-3-2-4-16(18)20(14,17)12-22/h2-9,14,17H,10-12H2,1H3,(H,21,23)/t14-,17-,20+/m0/s1
InChIKey	DQMKJEKBPCCZLS-GZRFBZBPSA-N
Literature Reference DOI	10.1002/anie.201310997
Molecular Weight	368.451 g/mol
SMILES	N1C([C@@]2(C[C@]3(CN(C[C@@]23c2ccccc12)S(=O)(=O)c1ccc(cc1)C)[H])[H])=O
SPLASH	splash10-0aou-3911000000-91c6eb16afa62014ee56
Source of Spectrum	ACI-53-SMS18-10
Synonyms	(3aR,4aR,10bR)-2-tosyl-1,2,3,3a,4,4a-hexahydropyrrolo[3',4':2,3]cyclobuta[1,2-c]quinolin-5(6H)-one
Wiley ID	1782200