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DIMETHYL-2,4A-DIHYDRO-5-METHYL-4A-(1-PROPENYL)-5H-PYRIDAZINO-[4,5-B]-INDOLE-1,4-DICARBOXYLATE
SpectraBase Compound ID 5neTDwx9WLy
InChI InChI=1S/C18H19N3O4/c1-5-10-18-13(11-8-6-7-9-12(11)21(18)2)14(16(22)24-3)19-20-15(18)17(23)25-4/h5-10,19H,1-4H3/b10-5+
InChIKey LSYUMFHHOCYQIN-BJMVGYQFSA-N
Mol Weight 341.37 g/mol
Molecular Formula C18H19N3O4
Exact Mass 341.137556 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 68xoBaklJyV
Name 2H-Pyridazino[4,5-b]indole-1,4-dicarboxylic acid, 4a,5-dihydro-5-methyl-4a-(1-propenyl)-, dimethyl ester, (E)-
CAS Registry Number 119690-47-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H19N3O4
InChI InChI=1S/C18H19N3O4/c1-5-10-18-13(11-8-6-7-9-12(11)21(18)2)14(16(22)24-3)19-20-15(18)17(23)25-4/h5-10,19H,1-4H3/b10-5+
InChIKey LSYUMFHHOCYQIN-BJMVGYQFSA-N
Molecular Weight 341.367 g/mol
SMILES N1C(=C2C(C(=N1)C(=O)OC)(N(c1ccccc21)C)\C=C\C)C(=O)OC
SPLASH splash10-0a59-9082000000-f55170b2d1438e3756a5
Source of Spectrum H-72-70-4
Synonyms Dimethyl 2,4a-dihydro-5-methyl-4a-(1-propenyl)-5H-pyridazino[4,5-b]indole-1,4-dicarboxylate Dimethyl 5-methyl-4a-[(1E)-1-propenyl]-4a,5-dihydro-2H-pyridazino[4,5-b]indole-1,4-dicarboxylate
Wiley ID 1335863