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5-(3,7-Dimethyl-1,4,6-octatrienyl)-5,8-dihydro-6-methyl-2-phenyl-1H-(1,2,4)triazolo(1,2-a)-pyridazine-1,3(2H)-dione
SpectraBase Compound ID 2LGuXBfV9ew
InChI InChI=1S/C23H27N3O2/c1-17(2)9-8-10-18(3)13-14-21-19(4)15-16-24-22(27)25(23(28)26(21)24)20-11-6-5-7-12-20/h5-15,18,21H,16H2,1-4H3/b10-8+,14-13+
InChIKey NQVIIOMSSKOXDX-UBLABLSGSA-N
Mol Weight 377.49 g/mol
Molecular Formula C23H27N3O2
Exact Mass 377.210327 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EBiJp0sArea
Name 5-(3,7-Dimethyl-1,4,6-octatrienyl)-5,8-dihydro-6-methyl-2-phenyl-1H-(1,2,4)triazolo(1,2-a)-pyridazine-1,3(2H)-dione
Alternate Name(s) 5-[(1E,4E)-3,7-dimethyl-1,4,6-octatrienyl]-6-methyl-2-phenyl-5,8-dihydro-1H-[1,2,4]triazolo[1,2-a]pyridazine-1,3(2H)-dione
CAS Registry Number 73368-18-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H27N3O2
InChI InChI=1S/C23H27N3O2/c1-17(2)9-8-10-18(3)13-14-21-19(4)15-16-24-22(27)25(23(28)26(21)24)20-11-6-5-7-12-20/h5-15,18,21H,16H2,1-4H3/b10-8+,14-13+
InChIKey NQVIIOMSSKOXDX-UBLABLSGSA-N
Molecular Weight 377.488 g/mol
SMILES C1(N(C(N2CC=C(C(N12)\C=C\C(\C=C\C=C(C)C)C)C)=O)c1ccccc1)=O
SPLASH splash10-05ox-2985000000-c9239bccfedb42697f4d
Source of Spectrum J-45-2525-0
Wiley ID 1358337