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Protonitazene-A (-C2H5)
SpectraBase Compound ID 1FfLhOdaoYs
InChI InChI=1S/C21H26N4O3/c1-3-13-28-18-8-5-16(6-9-18)14-21-23-19-15-17(25(26)27)7-10-20(19)24(21)12-11-22-4-2/h5-10,15,22H,3-4,11-14H2,1-2H3
InChIKey NPHUSRHIDKYNDO-UHFFFAOYSA-N
Mol Weight 382.46 g/mol
Molecular Formula C21H26N4O3
Exact Mass 382.200491 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4fFC5WLyjNV
Name N-desethyl Protonitazene
Catalog Number 38154
Lot Number 670313
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Exact Mass 382.200490710 u
Formula C21H26N4O3
InChI InChI=1S/C21H26N4O3/c1-3-13-28-18-8-5-16(6-9-18)14-21-23-19-15-17(25(26)27)7-10-20(19)24(21)12-11-22-4-2/h5-10,15,22H,3-4,11-14H2,1-2H3
InChIKey NPHUSRHIDKYNDO-UHFFFAOYSA-N
Molecular Weight 382.464 g/mol
Purity >=98%
Quality 985
SMILES N(CCN1C2=CC=C(C=C2N=C1CC1=CC=C(OCCC)C=C1)[N+]([O-])=O)CC
SPLASH splash10-0a4j-8921000000-6aded83782f23234b25d
Source of Spectrum CAY-2024-2260-0
Synonyms N-ethyl-2-(5-nitro-2-(4-propoxybenzyl)-1H-benzo[d]imidazol-1-yl)ethan-1-amine ethyl(2-{5-nitro-2-[(4-propoxyphenyl)methyl]-1H-1,3-benzodiazol-1-yl}ethyl)amine
Wiley ID 1890445