(S)-Methyl-1-((3aS,4S,7aS)-5-bromo-2-methyl-1,3-dioxo-2,3,3a,4,7,7a-hexahydro-1H-isoindol-4-yl)-5-oxopyrrolidine-2-carboxylate

SpectraBase Compound ID	KXTWMIA6pNv
InChI	InChI=1S/C15H17BrN2O5/c1-17-13(20)7-3-4-8(16)12(11(7)14(17)21)18-9(15(22)23-2)5-6-10(18)19/h4,7,9,11-12H,3,5-6H2,1-2H3/t7-,9-,11-,12+/m0/s1
InChIKey	IYTLAFMXIGRDMB-JMWNJNDNSA-N Google Search
Mol Weight	385.21 g/mol
Molecular Formula	C15H17BrN2O5
Exact Mass	384.032085 g/mol

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SpectraBase Spectrum ID	2s0OAiUhI4g
Name	(S)-Methyl-1-((3aS,4S,7aS)-5-bromo-2-methyl-1,3-dioxo-2,3,3a,4,7,7a-hexahydro-1H-isoindol-4-yl)-5-oxopyrrolidine-2-carboxylate
Alternate Name(s)	(S)-methyl 1-((3aS,4S,7aS)-5-bromo-2-methyl-1,3-dioxo-2,3,3a,4,7,7a-hexahydro-1H-isoindol-4-yl)-5-oxopyrrolidine-2-carboxylate (2S)-1-[(3aS,4S,7aS)-5-bromo-2-methyl-1,3-dioxo-3a,4,7,7a-tetrahydroisoindol-4-yl]-5-oxo-2-pyrrolidinecarboxylic acid methyl ester Methyl (2S)-1-[(3aS,4S,7aS)-5-bromo-2-methyl-1,3-dioxo-3a,4,7,7a-tetrahydroisoindol-4-yl]-5-oxopyrrolidine-2-carboxylate Methyl (2S)-1-[(3aS,4S,7aS)-5-bromo-2-methyl-1,3-dioxo-3a,4,7,7a-tetrahydroisoindol-4-yl]-5-oxo-pyrrolidine-2-carboxylate Methyl (2S)-1-[(3aS,4S,7aS)-5-bromanyl-2-methyl-1,3-bis(oxidanylidene)-3a,4,7,7a-tetrahydroisoindol-4-yl]-5-oxidanylidene-pyrrolidine-2-carboxylate
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C15H17BrN2O5
InChI	InChI=1S/C15H17BrN2O5/c1-17-13(20)7-3-4-8(16)12(11(7)14(17)21)18-9(15(22)23-2)5-6-10(18)19/h4,7,9,11-12H,3,5-6H2,1-2H3/t7-,9-,11-,12+/m0/s1
InChIKey	IYTLAFMXIGRDMB-JMWNJNDNSA-N
Literature Reference DOI	10.1002/asia.200700031
Molecular Weight	385.214 g/mol
SMILES	C1(=CC[C@]2([C@@]([C@@]1(N1C(CC[C@]1(C(OC)=O)[H])=O)[H])(C(N(C2=O)C)=O)[H])[H])Br
SPLASH	splash10-0a4i-6309000000-7639924f324814ba2a01
Source of Spectrum	CAJ-2-743-9
Wiley ID	1774978