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Sulfoximine, N,N'-1,6-hexanediylbis[S-(2-methoxyphenyl)-S-(4-methylphenyl)-, [S-(R*,R*)]-
SpectraBase Compound ID Du2CzvSdvds
InChI InChI=1S/C34H40N2O4S2/c1-27-17-21-29(22-18-27)41(37,33-15-9-7-13-31(33)39-3)35-25-11-5-6-12-26-36-42(38,30-23-19-28(2)20-24-30)34-16-10-8-14-32(34)40-4/h7-10,13-24H,5-6,11-12,25-26H2,1-4H3/t41-,42-/m0/s1
InChIKey XNXPEYQHMODRLT-COCZKOEFSA-N
Mol Weight 604.8 g/mol
Molecular Formula C34H40N2O4S2
Exact Mass 604.24295 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Jw8VLyIVKLG
Name Sulfoximine, N,N'-1,6-hexanediylbis[S-(2-methoxyphenyl)-S-(4-methylphenyl)-, [S-(R*,R*)]-
Alternate Name(s) (S,S)-N,N'-(hexane-1,6-diyl)bis(s-O-methoxyphenyl-S-p-tolylsulfoximine) 1-Methoxy-2-[(6-{[(2-methoxyphenyl)(4-methylphenyl)oxido-lambda(4)-sulfanylidene]amino}hexyl)(4-methylphenyl)sulfonimidoyl]benzene
CAS Registry Number 113344-67-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C34H40N2O4S2
InChI InChI=1S/C34H40N2O4S2/c1-27-17-21-29(22-18-27)41(37,33-15-9-7-13-31(33)39-3)35-25-11-5-6-12-26-36-42(38,30-23-19-28(2)20-24-30)34-16-10-8-14-32(34)40-4/h7-10,13-24H,5-6,11-12,25-26H2,1-4H3/t41-,42-/m0/s1
InChIKey XNXPEYQHMODRLT-COCZKOEFSA-N
Molecular Weight 604.824 g/mol
SMILES c1([S@@](c2ccc(cc2)C)(=NCCCCCCN=[S@@](c2c(OC)cccc2)(c2ccc(cc2)C)=O)=O)c(OC)cccc1
SPLASH splash10-002b-0391000000-3b98009d50c226b464dc
Source of Spectrum B-40-71-7
Wiley ID 1410472