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2,5-Dimethyl-6-[N-methyl-S-(phenylsulfonimidoyl)]-4-phenyl-5-hexen-3-yl carbamate
SpectraBase Compound ID 9UataMiDnFo
InChI InChI=1S/C22H28N2O3S/c1-16(2)21(27-22(23)25)20(18-11-7-5-8-12-18)17(3)15-28(26,24-4)19-13-9-6-10-14-19/h5-16,20-21H,1-4H3,(H2,23,25)/b17-15-/t20-,21-,28?/m0/s1
InChIKey DBEGXSVTWSIPLP-ZZZHYEBPSA-N
Mol Weight 400.54 g/mol
Molecular Formula C22H28N2O3S
Exact Mass 400.182064 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID hKdH1Lkgls
Name 2,5-Dimethyl-6-[N-methyl-S-(phenylsulfonimidoyl)]-4-phenyl-5-hexen-3-yl carbamate
Alternate Name(s) Carbamic acid [(Z,3S,4R)-2,5-dimethyl-6-(N-methyl-S-phenylsulfonimidoyl)-4-phenylhex-5-en-3-yl] ester [(Z,3S,4R)-2,5-dimethyl-6-(N-methyl-S-phenylsulfonimidoyl)-4-phenylhex-5-en-3-yl] carbamate [(Z,1S,2R)-1-isopropyl-3-methyl-4-(N-methyl-S-phenyl-sulfonimidoyl)-2-phenyl-but-3-enyl] carbamate [(Z,3S,4R)-2,5-dimethyl-6-(N-methyl-S-phenyl-sulfonimidoyl)-4-phenyl-hex-5-en-3-yl] carbamate
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Formula C22H28N2O3S
InChI InChI=1S/C22H28N2O3S/c1-16(2)21(27-22(23)25)20(18-11-7-5-8-12-18)17(3)15-28(26,24-4)19-13-9-6-10-14-19/h5-16,20-21H,1-4H3,(H2,23,25)/b17-15-/t20-,21-,28?/m0/s1
InChIKey DBEGXSVTWSIPLP-ZZZHYEBPSA-N
Molecular Weight 400.537 g/mol
SMILES NC(O[C@]([C@@](\C(=C/S(=NC)(=O)c1ccccc1)C)(c1ccccc1)[H])(C(C)C)[H])=O
SPLASH splash10-003r-0900000000-27a7c049642bae80caf4
Source of Spectrum K1-2003-1515-8
Wiley ID 1520924