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Calmagite

View entire compound with spectra: 4 FTIR

Calmagite
SpectraBase Compound ID 1LjOPcky8v6
InChI InChI=1S/C17H14N2O5S/c1-10-6-7-14(20)13(8-10)18-19-17-12-5-3-2-4-11(12)16(9-15(17)21)25(22,23)24/h2-9,20-21H,1H3,(H,22,23,24)/b19-18+
InChIKey VBRNLOQCBCPPHL-VHEBQXMUSA-N
Mol Weight 358.37 g/mol
Molecular Formula C17H14N2O5S
Exact Mass 358.062343 g/mol

Attenuated Total Reflectance Infrared (ATR-IR) Spectrum

Attenuated Total Reflectance Infrared (ATR-IR) Spectrum

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SpectraBase Spectrum ID SQ4ylegd7
Name Calmagite
Source of Sample Sigma-Aldrich Inc.
Catalog Number C-3259
Lot Number 37C-0204
Accessory DurasamplIR II
CAS Registry Number 3147-14-6
Compound Type Pure
Copyright Copyright © 2012-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H14N2O5S
InChI InChI=1S/C17H14N2O5S/c1-10-6-7-14(20)13(8-10)18-19-17-12-5-3-2-4-11(12)16(9-15(17)21)25(22,23)24/h2-9,20-21H,1H3,(H,22,23,24)/b19-18+
InChIKey VBRNLOQCBCPPHL-VHEBQXMUSA-N
Instrument Name Bio-Rad FTS
Source of Spectrum Forensic Spectral Research
Technique ATR-Neat (DuraSamplIR II)