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1-[4-(diethylamino)but-2-ynyl]pyrazole-3,5-dicarboxylic acid diethyl ester
SpectraBase Compound ID 3ZnZWkBPPMQ
InChI InChI=1S/C17H25N3O4/c1-5-19(6-2)11-9-10-12-20-15(17(22)24-8-4)13-14(18-20)16(21)23-7-3/h13H,5-8,11-12H2,1-4H3
InChIKey GDJVBBCZRNYIDH-UHFFFAOYSA-N
Mol Weight 335.4 g/mol
Molecular Formula C17H25N3O4
Exact Mass 335.184506 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 943CNIC089q
Name 1-[4-(diethylamino)but-2-ynyl]pyrazole-3,5-dicarboxylic acid diethyl ester
Comments Less than 3 mono-isotopic peaks
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Formula C17H25N3O4
InChI InChI=1S/C17H25N3O4/c1-5-19(6-2)11-9-10-12-20-15(17(22)24-8-4)13-14(18-20)16(21)23-7-3/h13H,5-8,11-12H2,1-4H3
InChIKey GDJVBBCZRNYIDH-UHFFFAOYSA-N
Molecular Weight 335.404 g/mol
SMILES c1(cc(C(=O)OCC)n[n]1CC#CCN(CC)CC)C(=O)OCC
SPLASH splash10-00di-0900000000-60e938a91cc893c8465c
Source of Spectrum D9-335-344-8
Synonyms diethyl 1-[4-(diethylamino)but-2-ynyl]pyrazole-3,5-dicarboxylate
Wiley ID 1550956