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5-(cyanomethyl)-1H-pyrrole-2-carboxylic acid methyl ester
SpectraBase Compound ID CFfPJoeS0IE
InChI InChI=1S/C8H8N2O2/c1-12-8(11)7-3-2-6(10-7)4-5-9/h2-3,10H,4H2,1H3
InChIKey LGNMUDKJMWFZQG-UHFFFAOYSA-N
Mol Weight 164.16 g/mol
Molecular Formula C8H8N2O2
Exact Mass 164.058578 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BmgOcbUaitB
Name 5-(cyanomethyl)-1H-pyrrole-2-carboxylic acid methyl ester
Alternate Name(s) Methyl 5-(cyanomethyl)-1H-pyrrole-2-carboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H8N2O2
InChI InChI=1S/C8H8N2O2/c1-12-8(11)7-3-2-6(10-7)4-5-9/h2-3,10H,4H2,1H3
InChIKey LGNMUDKJMWFZQG-UHFFFAOYSA-N
Molecular Weight 164.164 g/mol
SMILES [nH]1c(ccc1C(=O)OC)CC#N
SPLASH splash10-0gx0-1900000000-a92159e47ebfdf201cf0
Source of Spectrum J-57-6819-0
Wiley ID 1160007