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2-Methylene-9-[(phenylmethyl)-(trifluoromethylsulfonyl)amino]nonanoic acid ethyl ester
SpectraBase Compound ID BtftgoMvuZH
InChI InChI=1S/C20H28F3NO4S/c1-3-28-19(25)17(2)12-8-5-4-6-11-15-24(29(26,27)20(21,22)23)16-18-13-9-7-10-14-18/h7,9-10,13-14H,2-6,8,11-12,15-16H2,1H3
InChIKey VQRHEURYJONMJR-UHFFFAOYSA-N
Mol Weight 435.5 g/mol
Molecular Formula C20H28F3NO4S
Exact Mass 435.169114 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID m4svQ2d10m
Name 2-Methylene-9-[(phenylmethyl)-(trifluoromethylsulfonyl)amino]nonanoic acid ethyl ester
Alternate Name(s) 2-[7-[benzyl(triflyl)amino]heptyl]acrylic acid ethyl ester Ethyl 2-methylidene-9-[(phenylmethyl)-(trifluoromethylsulfonyl)amino]nonanoate Ethyl 9-[benzyl(trifluoromethylsulfonyl)amino]-2-methylene-nonanoate Ethyl 9-[benzyl(trifluoromethylsulfonyl)amino]-2-methylidenenonanoate
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Formula C20H28F3NO4S
InChI InChI=1S/C20H28F3NO4S/c1-3-28-19(25)17(2)12-8-5-4-6-11-15-24(29(26,27)20(21,22)23)16-18-13-9-7-10-14-18/h7,9-10,13-14H,2-6,8,11-12,15-16H2,1H3
InChIKey VQRHEURYJONMJR-UHFFFAOYSA-N
Molecular Weight 435.502 g/mol
SMILES C(S(N(Cc1ccccc1)CCCCCCCC(C(=O)OCC)=C)(=O)=O)(F)(F)F
SPLASH splash10-0006-9004000000-66c11303300fe7b6df15
Source of Spectrum J-61-7479-7
Wiley ID 1383205