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N-(1-Phenylselenomethyl)heptadecyl-4-methylbenzensulfonamide
SpectraBase Compound ID 6dxwOUmR1vP
InChI InChI=1S/C31H49NO2SSe/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-17-20-29(27-36-31-21-18-16-19-22-31)32-35(33,34)30-25-23-28(2)24-26-30/h16,18-19,21-26,29,32H,3-15,17,20,27H2,1-2H3
InChIKey PWLUJXJRZLHHIT-UHFFFAOYSA-N
Mol Weight 578.8 g/mol
Molecular Formula C31H49NO2SSe
Exact Mass 579.264923 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BfRyb9mf9KS
Name N-(1-Phenylselenomethyl)heptadecyl-4-methylbenzensulfonamide
Alternate Name(s) 4-Methyl-N-(1-(phenylselanyl)octadecan-2-yl)benzenesulfonamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C31H49NO2SSe
InChI InChI=1S/C31H49NO2SSe/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-17-20-29(27-36-31-21-18-16-19-22-31)32-35(33,34)30-25-23-28(2)24-26-30/h16,18-19,21-26,29,32H,3-15,17,20,27H2,1-2H3
InChIKey PWLUJXJRZLHHIT-UHFFFAOYSA-N
Literature Reference DOI 10.1002/cjoc.200790325
Molecular Weight 578.770 g/mol
SMILES N(S(=O)(c1ccc(cc1)C)=O)C(CCCCCCCCCCCCCCCC)C[Se]c1ccccc1
SPLASH splash10-0a70-5904100000-0e9df7eac1d09646db3e
Source of Spectrum CJC-25-1760-4f
Wiley ID 1774394