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Disperse Red 13
SpectraBase Compound ID I1MLXKOvj2Y
InChI InChI=1S/C16H17ClN4O3/c1-2-20(9-10-22)13-5-3-12(4-6-13)18-19-16-8-7-14(21(23)24)11-15(16)17/h3-8,11,22H,2,9-10H2,1H3
InChIKey FEJPWLNPOFOBSP-UHFFFAOYSA-N
Mol Weight 348.79 g/mol
Molecular Formula C16H17ClN4O3
Exact Mass 348.098918 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8kuNBfAd4VE
Name Disperse Red 13
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H17ClN4O3
InChI InChI=1S/C16H17ClN4O3/c1-2-20(9-10-22)13-5-3-12(4-6-13)18-19-16-8-7-14(21(23)24)11-15(16)17/h3-8,11,22H,2,9-10H2,1H3
InChIKey FEJPWLNPOFOBSP-UHFFFAOYSA-N
Instrument Name Finnigan-MAT TSQ
Ionization Type EI
Literature Reference DOI 10.1002/rcm.1290040705
Molecular Weight 348.790 g/mol
SMILES OCCN(c1ccc(N=Nc2c(cc(cc2)[N+](=O)[O-])Cl)cc1)CC
SPLASH splash10-000x-2900000000-4bec82610814b0156fae
Source of Spectrum RCM-4-247-3
Wiley ID 1837182