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Methanesulfonic acid, trifluoro-, 1-isoquinolinyl ester
SpectraBase Compound ID DIXFlS0ybwm
InChI InChI=1S/C10H6F3NO3S/c11-10(12,13)18(15,16)17-9-8-4-2-1-3-7(8)5-6-14-9/h1-6H
InChIKey LKRXPWBAEDPVJK-UHFFFAOYSA-N
Mol Weight 277.22 g/mol
Molecular Formula C10H6F3NO3S
Exact Mass 277.002049 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 33Id4gZ2wmA
Name Methanesulfonic acid, trifluoro-, 1-isoquinolinyl ester
CAS Registry Number 123172-86-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H6F3NO3S
InChI InChI=1S/C10H6F3NO3S/c11-10(12,13)18(15,16)17-9-8-4-2-1-3-7(8)5-6-14-9/h1-6H
InChIKey LKRXPWBAEDPVJK-UHFFFAOYSA-N
Molecular Weight 277.217 g/mol
SMILES c1(OS(C(F)(F)F)(=O)=O)nccc2c1cccc2
SPLASH splash10-016u-0930000000-d115a1c8b4bbe748583c
Source of Spectrum B-42-282-0
Synonyms 1-Isoquinolyl trifluoromethanesulfonate isoquinolin-1-yl trifluoromethanesulfonate isoquinolin-1-yl tris(fluoranyl)methanesulfonate Trifluoromethanesulfonic acid 1-isoquinolinyl ester Trifluoromethanesulfonic acid 1-isoquinolyl ester
Wiley ID 1280762