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1H-Pyrrole-2-carboximidic acid, N-(3-cyano-2-methylphenyl)-, ethyl ester
SpectraBase Compound ID G72U8yxFU7n
InChI InChI=1S/C15H15N3O/c1-3-19-15(14-8-5-9-17-14)18-13-7-4-6-12(10-16)11(13)2/h4-9,17H,3H2,1-2H3/b18-15+
InChIKey DZBTXHUHVBWUFY-OBGWFSINSA-N
Mol Weight 253.3 g/mol
Molecular Formula C15H15N3O
Exact Mass 253.121512 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Fb44TSKpjd
Name 1H-Pyrrole-2-carboximidic acid, N-(3-cyano-2-methylphenyl)-, ethyl ester
Alternate Name(s) Ethyl N-(3-cyano-2-methylphenyl)-1H-pyrrole-2-carboximidoate N-(3-cyano-2-methylphenyl)-imino-ethylpyrrole 2-carboxylate
CAS Registry Number 79237-97-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H15N3O
InChI InChI=1S/C15H15N3O/c1-3-19-15(14-8-5-9-17-14)18-13-7-4-6-12(10-16)11(13)2/h4-9,17H,3H2,1-2H3/b18-15+
InChIKey DZBTXHUHVBWUFY-OBGWFSINSA-N
Molecular Weight 253.305 g/mol
SMILES [nH]1cccc1\C(=N/c1c(c(C#N)ccc1)C)OCC
SPLASH splash10-0k9x-5590000000-23d219d4c2e9e57ed0c0
Source of Spectrum F-37-2101-0
Wiley ID 1256850