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7-Methoxy-5H-dibenz[c,e]azepinium trifluoromethanesulphonate
SpectraBase Compound ID 98PLkXKBk0q
InChI InChI=1S/C15H13NO.CHF3O3S/c1-17-15-14-9-5-4-8-13(14)12-7-3-2-6-11(12)10-16-15;2-1(3,4)8(5,6)7/h2-9H,10H2,1H3;(H,5,6,7)
InChIKey MVCVVHOHZFKJKG-UHFFFAOYSA-N
Mol Weight 373.35 g/mol
Molecular Formula C16H14F3NO4S
Exact Mass 373.059564 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID F47N798cv7o
Name 7-Methoxy-5H-dibenz[c,e]azepinium trifluoromethanesulphonate
CAS Registry Number 134080-01-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H14F3NO4S
InChI InChI=1S/C15H13NO.CHF3O3S/c1-17-15-14-9-5-4-8-13(14)12-7-3-2-6-11(12)10-16-15;2-1(3,4)8(5,6)7/h2-9H,10H2,1H3;(H,5,6,7)
InChIKey MVCVVHOHZFKJKG-UHFFFAOYSA-N
Molecular Weight 373.346 g/mol
SMILES [NH+]=1Cc2c(-c3c(C1OC)cccc3)cccc2.C(S([O-])(=O)=O)(F)(F)F
SPLASH splash10-00di-0490000000-510367afcae6f6a899be
Source of Spectrum K-124-2088-7
Synonyms 7-Methoxy-5H-dibenzo[c,e]azepinium trifluoromethanesulfonate
Wiley ID 1356009