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1-Butanesulfonic acid, 1,1,2,2,3,3,4,4,4-nonafluoro-, compound with N-[4-(bromophenyl)methyl)-2-furanmethanamine, (1:1)
SpectraBase Compound ID LgRrIQmPpj2
InChI InChI=1S/C12H12BrNO.C4HF9O3S/c13-11-5-3-10(4-6-11)8-14-9-12-2-1-7-15-12;5-1(6,3(9,10)11)2(7,8)4(12,13)17(14,15)16/h1-7,14H,8-9H2;(H,14,15,16)
InChIKey OJNNWQFHWYOXOP-UHFFFAOYSA-N
Mol Weight 566.23 g/mol
Molecular Formula C16H13BrF9NO4S
Exact Mass 564.960496 g/mol

Transmission Infrared (IR) Spectrum

Transmission Infrared (IR) Spectrum

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SpectraBase Spectrum ID E3P89eTOeql
Name 1-Butanesulfonic acid, 1,1,2,2,3,3,4,4,4-nonafluoro-, compound with N-[4-(bromophenyl)methyl)-2-furanmethanamine, (1:1)
CAS Registry Number 45187-15-3
Copyright Copyright © 1989, 1990-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C16H13BrF9NO4S
InChI InChI=1S/C12H12BrNO.C4HF9O3S/c13-11-5-3-10(4-6-11)8-14-9-12-2-1-7-15-12;5-1(6,3(9,10)11)2(7,8)4(12,13)17(14,15)16/h1-7,14H,8-9H2;(H,14,15,16)
InChIKey OJNNWQFHWYOXOP-UHFFFAOYSA-N
Instrument Name Bruker IFS 112
Technique KBr-Pellet