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N-((3aS,4S,7aS)-2,5,7-trimethyl-1,3-dioxo-2,3,3a,4,7,7a-hexahydro-1H-isoindol-4-yl)methanesulfonamide
SpectraBase Compound ID K7U4BPr0h6w
InChI InChI=1S/C12H18N2O4S/c1-6-5-7(2)10(13-19(4,17)18)9-8(6)11(15)14(3)12(9)16/h5-6,8-10,13H,1-4H3/t6?,8-,9-,10+/m0/s1
InChIKey RNNPODGWAFMWJF-BTPSSZJASA-N
Mol Weight 286.35 g/mol
Molecular Formula C12H18N2O4S
Exact Mass 286.098728 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HHhuMpElNbA
Name N-((3aS,4S,7aS)-2,5,7-trimethyl-1,3-dioxo-2,3,3a,4,7,7a-hexahydro-1H-isoindol-4-yl)methanesulfonamide
Alternate Name(s) N-[(3aS,4S,7aS)-2,5,7-trimethyl-1,3-dioxo-3a,4,7,7a-tetrahydroisoindol-4-yl]methanesulfonamide N-[(3aS,4S,7aS)-2,5,7-trimethyl-1,3-bis(oxidanylidene)-3a,4,7,7a-tetrahydroisoindol-4-yl]methanesulfonamide
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Formula C12H18N2O4S
InChI InChI=1S/C12H18N2O4S/c1-6-5-7(2)10(13-19(4,17)18)9-8(6)11(15)14(3)12(9)16/h5-6,8-10,13H,1-4H3/t6?,8-,9-,10+/m0/s1
InChIKey RNNPODGWAFMWJF-BTPSSZJASA-N
Literature Reference DOI 10.1002/adsc.200404056
Molecular Weight 286.346 g/mol
SMILES N(S(=O)(=O)C)[C@]1([C@]2(C(N(C([C@]2(C(C=C1C)C)[H])=O)C)=O)[H])[H]
SPLASH splash10-0a6v-9420000000-88593aba656fc9abed5c
Source of Spectrum ASC-346-975-1c
Wiley ID 1767639