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1-(Benzylamino)methyl-2-[(trifluoromethanesulfonyl)oxy]-1-cycloheptene
SpectraBase Compound ID EZSsqcqjkoA
InChI InChI=1S/C16H20F3NO3S/c17-16(18,19)24(21,22)23-15-10-6-2-5-9-14(15)12-20-11-13-7-3-1-4-8-13/h1,3-4,7-8,20H,2,5-6,9-12H2
InChIKey OFMDTHYDBYKNBA-UHFFFAOYSA-N
Mol Weight 363.4 g/mol
Molecular Formula C16H20F3NO3S
Exact Mass 363.111599 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID L3ymBHAucmg
Name 1-(Benzylamino)methyl-2-[(trifluoromethanesulfonyl)oxy]-1-cycloheptene
Alternate Name(s) 2-[(benzylamino)methyl]-1-cyclohepten-1-yl trifluoromethanesulfonate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H20F3NO3S
InChI InChI=1S/C16H20F3NO3S/c17-16(18,19)24(21,22)23-15-10-6-2-5-9-14(15)12-20-11-13-7-3-1-4-8-13/h1,3-4,7-8,20H,2,5-6,9-12H2
InChIKey OFMDTHYDBYKNBA-UHFFFAOYSA-N
Molecular Weight 363.395 g/mol
SMILES N(CC1=C(OS(C(F)(F)F)(=O)=O)CCCCC1)Cc1ccccc1
SPLASH splash10-001i-0090000000-187aa790ded3f603350b
Source of Spectrum F-51-5591-3
Wiley ID 791877