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A-839977
SpectraBase Compound ID 6JSrP6I1pMt
InChI InChI=1S/C19H14Cl2N6O/c20-14-7-5-8-15(18(14)21)27-19(24-25-26-27)23-12-13-6-1-2-9-16(13)28-17-10-3-4-11-22-17/h1-11H,12H2,(H,23,24,26)
InChIKey GMVNBKZQJFRFAR-UHFFFAOYSA-N
Mol Weight 413.27 g/mol
Molecular Formula C19H14Cl2N6O
Exact Mass 412.060614 g/mol

Attenuated Total Reflectance Infrared (ATR-IR) Spectrum

Attenuated Total Reflectance Infrared (ATR-IR) Spectrum

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SpectraBase Spectrum ID C5l1Qmc5c34
Name A-839977
Source of Sample Cayman Chemical Company
Catalog Number 30934
Lot Number 0680129-2
Accessory DurasamplIR II
CAS Registry Number 870061-27-1
Copyright Copyright © 2019-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 412.060614494 u
Formula C19H14Cl2N6O
InChI InChI=1S/C19H14Cl2N6O/c20-14-7-5-8-15(18(14)21)27-19(24-25-26-27)23-12-13-6-1-2-9-16(13)28-17-10-3-4-11-22-17/h1-11H,12H2,(H,23,24,26)
InChIKey GMVNBKZQJFRFAR-UHFFFAOYSA-N
Instrument Name Bio-Rad FTS
Molecular Weight 413.268 g/mol
Purity ≥98%
Resolution 4
SMILES C1(=NN=NN1C=1C(=C(C=CC1)Cl)Cl)NCC=1C(=CC=CC1)OC=1C=CC=CN1
Scan Speed (number) 5
Source of Spectrum Forensic Spectral Research
Synonyms 1-(2,3-dichlorophenyl)-N-[[2-(2-pyridinyloxy)phenyl]methyl]-1H-tetrazol-5-amine
Technique ATR-Neat