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2-Acetyl-3,7-dimethylbenzo(B)thiophene 2,4-dinitrophenylhydrazone

View entire compound with spectra: 1 NMR

2-Acetyl-3,7-dimethylbenzo(B)thiophene 2,4-dinitrophenylhydrazone
SpectraBase Compound ID FS4KMZvxzDZ
InChI InChI=1S/C18H16N4O4S/c1-10-5-4-6-14-11(2)18(27-17(10)14)12(3)19-20-15-8-7-13(21(23)24)9-16(15)22(25)26/h4-9,20H,1-3H3/b19-12+
InChIKey OGWUAGSNGUCGBE-XDHOZWIPSA-N
Mol Weight 384.41 g/mol
Molecular Formula C18H16N4O4S
Exact Mass 384.089226 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6Mg5OKE8bGt
Name 2-Acetyl-3,7-dimethylbenzo(B)thiophene 2,4-dinitrophenylhydrazone
Comments Computed using HOSE algorithm
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Exact Mass 384.089226181 u
Formula C18H16N4O4S
InChI InChI=1S/C18H16N4O4S/c1-10-5-4-6-14-11(2)18(27-17(10)14)12(3)19-20-15-8-7-13(21(23)24)9-16(15)22(25)26/h4-9,20H,1-3H3/b19-12+
InChIKey OGWUAGSNGUCGBE-XDHOZWIPSA-N
Molecular Weight 384.410 g/mol
SMILES C12=C(C(=CC=C2)C)SC(=C1C)\C(=N\NC1=C(C=C(C=C1)N(=O)=O)N(=O)=O)C