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1-{[2'-(3"-p-Nitrobenzylidene)aminomethyl-4"-methyl]thien-2'-yl}-pyrrole
SpectraBase Compound ID 6muBW22ye74
InChI InChI=1S/C17H15N3O2S/c1-13-12-23-17(19-8-2-3-9-19)16(13)11-18-10-14-4-6-15(7-5-14)20(21)22/h2-10,12H,11H2,1H3/b18-10+
InChIKey OWDHMHFUPYMJHX-VCHYOVAHSA-N
Mol Weight 325.39 g/mol
Molecular Formula C17H15N3O2S
Exact Mass 325.088498 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CBrpMhgMOdU
Name 1-{[2'-(3"-p-Nitrobenzylidene)aminomethyl-4"-methyl]thien-2'-yl}-pyrrole
Comments Less than 3 mono-isotopic peaks
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Formula C17H15N3O2S
InChI InChI=1S/C17H15N3O2S/c1-13-12-23-17(19-8-2-3-9-19)16(13)11-18-10-14-4-6-15(7-5-14)20(21)22/h2-10,12H,11H2,1H3/b18-10+
InChIKey OWDHMHFUPYMJHX-VCHYOVAHSA-N
Molecular Weight 325.386 g/mol
SMILES c1(c(c(C)cs1)C\N=C\c1ccc(N(=O)=O)cc1)-[n]1cccc1
SPLASH splash10-004i-0906000000-1d8bccfe28f23cbd4326
Source of Spectrum D8-327-726-6
Wiley ID 1515472