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1H-Isoindole-1,3(2H)-dione, 2-[4-chloro-2-fluoro-5-[(tetrahydro-2H-thiopyran-3-yl)methoxy]phenyl]-4,5,6,7-tetrahydro-
SpectraBase Compound ID sY9iPDpLG3
InChI InChI=1S/C20H21ClFNO3S/c21-15-8-16(22)17(9-18(15)26-10-12-4-3-7-27-11-12)23-19(24)13-5-1-2-6-14(13)20(23)25/h8-9,12H,1-7,10-11H2
InChIKey PJCLXIKVLZOSJD-UHFFFAOYSA-N
Mol Weight 409.9 g/mol
Molecular Formula C20H21ClFNO3S
Exact Mass 409.091471 g/mol

Transmission Infrared (IR) Spectrum

Transmission Infrared (IR) Spectrum

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SpectraBase Spectrum ID AoVckDmT9uU
Name 1H-Isoindole-1,3(2H)-dione, 2-[4-chloro-2-fluoro-5-[(tetrahydro-2H-thiopyran-3-yl)methoxy]phenyl]-4,5,6,7-tetrahydro-
CAS Registry Number 122986-79-2
Copyright Copyright © 1989, 1990-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C20H21ClFNO3S
InChI InChI=1S/C20H21ClFNO3S/c21-15-8-16(22)17(9-18(15)26-10-12-4-3-7-27-11-12)23-19(24)13-5-1-2-6-14(13)20(23)25/h8-9,12H,1-7,10-11H2
InChIKey PJCLXIKVLZOSJD-UHFFFAOYSA-N
Instrument Name Bruker IFS 85
Purity slightly contaminated
Synonyms 2H-Thiopyran, 1H-isoindole-1,3(2H)-dione derivative.
Technique KBr-Pellet