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Methyl 1-[(aminocarbonyl)amino]-2-ethyl-5-[(E)-2-methoxy-1-ethenyl]-1H-3-pyrrolecarboxylate
SpectraBase Compound ID 80h28TCyffF
InChI InChI=1S/C12H17N3O4/c1-4-10-9(11(16)19-3)7-8(5-6-18-2)15(10)14-12(13)17/h5-7H,4H2,1-3H3,(H3,13,14,17)/b6-5+
InChIKey ZZYBCMYKLJRRCL-AATRIKPKSA-N
Mol Weight 267.28 g/mol
Molecular Formula C12H17N3O4
Exact Mass 267.121906 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4revkxDOAnu
Name Methyl 1-[(aminocarbonyl)amino]-2-ethyl-5-[(E)-2-methoxy-1-ethenyl]-1H-3-pyrrolecarboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H17N3O4
InChI InChI=1S/C12H17N3O4/c1-4-10-9(11(16)19-3)7-8(5-6-18-2)15(10)14-12(13)17/h5-7H,4H2,1-3H3,(H3,13,14,17)/b6-5+
InChIKey ZZYBCMYKLJRRCL-AATRIKPKSA-N
Literature Reference DOI 10.1021/ol800557h
Molecular Weight 267.285 g/mol
SMILES N([n]1c(c(C(OC)=O)cc1\C=C\OC)CC)C(N)=O
SPLASH splash10-014i-0590000000-39120fcb233ff883089b
Source of Spectrum A1-10-1983/SMS11-5c
Synonyms (E)-methyl 2-ethyl-5-(2-methoxyvinyl)-1-ureido-1H-pyrrole-3-carboxylate
Wiley ID 1759427