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1-Benzyl-5-bromo-4-trifluoromethanesulfonyloxy-1,2,3,6-tetrahydropyridine
SpectraBase Compound ID Dwc5RX9OKAb
InChI InChI=1S/C13H13BrF3NO3S/c14-11-9-18(8-10-4-2-1-3-5-10)7-6-12(11)21-22(19,20)13(15,16)17/h1-5H,6-9H2
InChIKey HEOSGOXTQGSTKX-UHFFFAOYSA-N
Mol Weight 400.21 g/mol
Molecular Formula C13H13BrF3NO3S
Exact Mass 398.975162 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FdkVJNHx19B
Name 1-Benzyl-5-bromo-4-trifluoromethanesulfonyloxy-1,2,3,6-tetrahydropyridine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H13BrF3NO3S
InChI InChI=1S/C13H13BrF3NO3S/c14-11-9-18(8-10-4-2-1-3-5-10)7-6-12(11)21-22(19,20)13(15,16)17/h1-5H,6-9H2
InChIKey HEOSGOXTQGSTKX-UHFFFAOYSA-N
Molecular Weight 400.210 g/mol
SMILES C(S(OC1=C(CN(CC1)Cc1ccccc1)Br)(=O)=O)(F)(F)F
SPLASH splash10-0006-9000000000-0398bbcacb4660a0db52
Source of Spectrum QE-12-8340-2
Synonyms 1-Benzyl-5-bromo-1,2,3,6-tetrahydro-4-pyridinyl trifluoromethanesulfonate 1-Benzyl-5-bromo-4-trifluoromethanesulfonyl-1,2,3,6-tetrahydropyridine
Wiley ID 1587410