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7-(t-Butyl)-1-methylphenanthryl-9-(trifluoromethane)-sulfonate
SpectraBase Compound ID DCVRVw9ZMvf
InChI InChI=1S/C20H19F3O3S/c1-12-6-5-7-14-15-9-8-13(19(2,3)4)10-17(15)18(11-16(12)14)26-27(24,25)20(21,22)23/h5-11H,1-4H3
InChIKey LCFFSVFCMYJZIZ-UHFFFAOYSA-N
Mol Weight 396.42 g/mol
Molecular Formula C20H19F3O3S
Exact Mass 396.1007 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BjRJPq7wxLy
Name 7-(t-Butyl)-1-methylphenanthryl-9-(trifluoromethane)-sulfonate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H19F3O3S
InChI InChI=1S/C20H19F3O3S/c1-12-6-5-7-14-15-9-8-13(19(2,3)4)10-17(15)18(11-16(12)14)26-27(24,25)20(21,22)23/h5-11H,1-4H3
InChIKey LCFFSVFCMYJZIZ-UHFFFAOYSA-N
Molecular Weight 396.424 g/mol
SMILES C(S(Oc1c2c(ccc(c2)C(C)(C)C)c2c(c1)c(ccc2)C)(=O)=O)(F)(F)F
SPLASH splash10-03ds-0094000000-fdd2cfb6dca051beccf3
Source of Spectrum I-82-204-26
Wiley ID 1551613