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(2R,11AS)-2-METHYLSULFONYLOXY-1,2,3,10,11,11A-HEXAHYDROPYRROLO-[2,1-C]-[1,4]-BENZODIAZEPIN-5,11-DIONE
SpectraBase Compound ID 9FUvPhkm4Uj
InChI InChI=1S/C13H14N2O5S/c1-21(18,19)20-8-6-11-12(16)14-10-5-3-2-4-9(10)13(17)15(11)7-8/h2-5,8,11H,6-7H2,1H3,(H,14,16)/t8-,11+/m1/s1
InChIKey UVFQCKUEABQQJS-KCJUWKMLSA-N
Mol Weight 310.32 g/mol
Molecular Formula C13H14N2O5S
Exact Mass 310.062343 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8IOoMTvKKaF
Name (2R,11AS)-2-METHYLSULFONYLOXY-1,2,3,10,11,11A-HEXAHYDROPYRROLO-[2,1-C]-[1,4]-BENZODIAZEPIN-5,11-DIONE
Compound Number 18
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C13H14N2O5S
InChI InChI=1S/C13H14N2O5S/c1-21(18,19)20-8-6-11-12(16)14-10-5-3-2-4-9(10)13(17)15(11)7-8/h2-5,8,11H,6-7H2,1H3,(H,14,16)/t8-,11+/m1/s1
InChIKey UVFQCKUEABQQJS-KCJUWKMLSA-N
Literature Reference Author S.JOLIVET-FOUCHET,F.FABIS,P.BOVY,P.OCHSENBEIN,S.RAULT
Literature Reference Citation HETEROCYCLES,51,1257(1999)
Literature Reference DOI 10.3987/COM-98-8412
Molecular Weight 310.325 g/mol
Solvent DMSO-D6
Source File Reference UWVP7520