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Ethyl 2-propyl-1-(4-carboethoxybenzyl)pyrolo[2,3-d]imidazol-5-carboxylate
SpectraBase Compound ID 3XIdswiDgBo
InChI InChI=1S/C21H25N3O4/c1-4-7-18-23-19-17(12-16(22-19)21(26)28-6-3)24(18)13-14-8-10-15(11-9-14)20(25)27-5-2/h8-12,22H,4-7,13H2,1-3H3
InChIKey XXSXOACMDNPGRT-UHFFFAOYSA-N
Mol Weight 383.45 g/mol
Molecular Formula C21H25N3O4
Exact Mass 383.184506 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5Fdgi67TEx
Name Ethyl 2-propyl-1-(4-carboethoxybenzyl)pyrolo[2,3-d]imidazol-5-carboxylate
Alternate Name(s) Ethyl 1-[4-(ethoxycarbonyl)benzyl]-2-propyl-1,4-dihydropyrrolo[2,3-d]imidazole-5-carboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H25N3O4
InChI InChI=1S/C21H25N3O4/c1-4-7-18-23-19-17(12-16(22-19)21(26)28-6-3)24(18)13-14-8-10-15(11-9-14)20(25)27-5-2/h8-12,22H,4-7,13H2,1-3H3
InChIKey XXSXOACMDNPGRT-UHFFFAOYSA-N
Molecular Weight 383.448 g/mol
SMILES [nH]1c(cc2c1nc([n]2Cc1ccc(C(=O)OCC)cc1)CCC)C(=O)OCC
SPLASH splash10-08fu-0901000000-218f7d5150b60e573f05
Source of Spectrum Y1-36-815-8
Wiley ID 1527153