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5-(benzylamino)pent-1-en-2-yl trifluoromethanesulfonate
SpectraBase Compound ID 961weEv6rAP
InChI InChI=1S/C13H16F3NO3S/c1-11(20-21(18,19)13(14,15)16)6-5-9-17-10-12-7-3-2-4-8-12/h2-4,7-8,17H,1,5-6,9-10H2
InChIKey MDTGXQTZFHJPQW-UHFFFAOYSA-N
Mol Weight 323.33 g/mol
Molecular Formula C13H16F3NO3S
Exact Mass 323.080299 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CUi3wq5ORm3
Name 5-(benzylamino)pent-1-en-2-yl trifluoromethanesulfonate
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Formula C13H16F3NO3S
InChI InChI=1S/C13H16F3NO3S/c1-11(20-21(18,19)13(14,15)16)6-5-9-17-10-12-7-3-2-4-8-12/h2-4,7-8,17H,1,5-6,9-10H2
InChIKey MDTGXQTZFHJPQW-UHFFFAOYSA-N
Molecular Weight 323.330 g/mol
SMILES N(CCCC(=C)OS(=O)(=O)C(F)(F)F)Cc1ccccc1
SPLASH splash10-0006-9300000000-300aff92d6a0e20ec78b
Source of Spectrum SO-0-668-8
Synonyms 5-[(phenylmethyl)amino]pent-1-en-2-yl tris(fluoranyl)methanesulfonate Trifluoromethanesulfonic acid 1-[3-(benzylamino)propyl]vinyl ester Trifluoromethanesulfonic acid 5-[(phenylmethyl)amino]pent-1-en-2-yl ester
Wiley ID 1544991