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1-Bromo-3-[2-(N-tosylamino)ethyl]hepta-1,6-diene
SpectraBase Compound ID 1DVyJQwspCc
InChI InChI=1S/C16H22BrNO2S/c1-3-4-5-15(10-12-17)11-13-18-21(19,20)16-8-6-14(2)7-9-16/h3,6-10,12,15,18H,1,4-5,11,13H2,2H3/b12-10-
InChIKey TYHNRHHVQBQPPS-BENRWUELSA-N
Mol Weight 372.32 g/mol
Molecular Formula C16H22BrNO2S
Exact Mass 371.055463 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4YZZGQHFkav
Name 1-Bromo-3-[2-(N-tosylamino)ethyl]hepta-1,6-diene
Alternate Name(s) N-{3-[(Z)-2-bromoethenyl]-6-heptenyl}-4-methylbenzenesulfonamide
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Formula C16H22BrNO2S
InChI InChI=1S/C16H22BrNO2S/c1-3-4-5-15(10-12-17)11-13-18-21(19,20)16-8-6-14(2)7-9-16/h3,6-10,12,15,18H,1,4-5,11,13H2,2H3/b12-10-
InChIKey TYHNRHHVQBQPPS-BENRWUELSA-N
Molecular Weight 372.321 g/mol
SMILES N(S(c1ccc(cc1)C)(=O)=O)CCC(\C=C/Br)CCC=C
SPLASH splash10-000x-9200000000-9420d3b42c5835ef3d99
Source of Spectrum J-58-5461-50
Wiley ID 1354852