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Benzenesulfonamide, N-[3,4-dimethyl-1-(phenylmethyl)-2,4-pentadienyl]-4-methyl-N-(phenylmethyl)-, [S-(Z)]-
SpectraBase Compound ID 7VJOgvI3XeW
InChI InChI=1S/C28H31NO2S/c1-22(2)24(4)19-27(20-25-11-7-5-8-12-25)29(21-26-13-9-6-10-14-26)32(30,31)28-17-15-23(3)16-18-28/h5-19,27H,1,20-21H2,2-4H3/b24-19-/t27-/m1/s1
InChIKey RWSDOBOOXMLUKI-DWAVHZDUSA-N
Mol Weight 445.62 g/mol
Molecular Formula C28H31NO2S
Exact Mass 445.20755 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8cwMnW6Y5Rs
Name Benzenesulfonamide, N-[3,4-dimethyl-1-(phenylmethyl)-2,4-pentadienyl]-4-methyl-N-(phenylmethyl)-, [S-(Z)]-
Alternate Name(s) (2S)-(E)-N,N-benzyl-2-(4,5-dimethyl-1-phenyl)hexa-3,5-dienyl-p-toluenesulfonamide (2S)-(Z)-N,N-benzyl-2-(4,5-dimethyl-1-phenyl)hexa-3,5-dienyl-p-toluenesulfonamide N-benzyl-N-[(1S,2Z)-1-benzyl-3,4-dimethyl-2,4-pentadienyl]-4-methylbenzenesulfonamide
CAS Registry Number 74974-75-7
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C28H31NO2S
InChI InChI=1S/C28H31NO2S/c1-22(2)24(4)19-27(20-25-11-7-5-8-12-25)29(21-26-13-9-6-10-14-26)32(30,31)28-17-15-23(3)16-18-28/h5-19,27H,1,20-21H2,2-4H3/b24-19-/t27-/m1/s1
InChIKey RWSDOBOOXMLUKI-DWAVHZDUSA-N
Molecular Weight 445.621 g/mol
SMILES [C@](N(S(c1ccc(cc1)C)(=O)=O)Cc1ccccc1)(\C=C/(C(=C)C)C)(Cc1ccccc1)[H]
SPLASH splash10-0udi-0009000000-e227d8b8de43caef21bc
Source of Spectrum C-104-5725-0
Wiley ID 1386399