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4-(hexadecyloxy)-3-nitrobenzenesulfonyl fluoride
SpectraBase Compound ID AA5TKdPQx7p
InChI InChI=1S/C22H36FNO5S/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-18-29-22-17-16-20(30(23,27)28)19-21(22)24(25)26/h16-17,19H,2-15,18H2,1H3
InChIKey XDMSIVIJWGOHEH-UHFFFAOYSA-N
Mol Weight 445.6 g/mol
Molecular Formula C22H36FNO5S
Exact Mass 445.229823 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID wryzrgQRk
Name Benzenesulfonyl fluoride, 4-(hexadecyloxy)-3-nitro-
Alternate Name(s) 4-(hexadecyloxy)-3-nitrobenzene-1-sulfonyl fluoride 4-(hexadecyloxy)-3-nitrobenzenesulfonyl fluoride 4-Hexadecoxy-3-nitrobenzenesulfonyl fluoride 4-Hexadecoxy-3-nitro-benzenesulfonyl fluoride
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Formula C22H36FNO5S
InChI InChI=1S/C22H36FNO5S/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-18-29-22-17-16-20(30(23,27)28)19-21(22)24(25)26/h16-17,19H,2-15,18H2,1H3
InChIKey XDMSIVIJWGOHEH-UHFFFAOYSA-N
Molecular Weight 445.590 g/mol
SMILES CCCCCCCCCCCCCCCCOc1ccc(cc1[N+]([O-])=O)S(F)(=O)=O
SPLASH splash10-0a4l-9100000000-c75d59d7e64bcca24f38
Source of Spectrum JX-2015-4-560
Wiley ID 1725990