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Methyl 6-(2-formylpyrrol-2-yl)-6-oxohexanoate
SpectraBase Compound ID JDm17IJfvyy
InChI InChI=1S/C12H15NO4/c1-17-11(16)6-3-2-5-10(15)12(9-14)7-4-8-13-12/h4,7-9H,2-3,5-6H2,1H3
InChIKey QMSVPOJPCGUDRY-UHFFFAOYSA-N
Mol Weight 237.25 g/mol
Molecular Formula C12H15NO4
Exact Mass 237.100108 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ESNqxZcScdH
Name Methyl 6-(2-formylpyrrol-2-yl)-6-oxohexanoate
Alternate Name(s) Methyl 6-(2-formyl-2H-pyrrol-2-yl)-6-oxohexanoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H15NO4
InChI InChI=1S/C12H15NO4/c1-17-11(16)6-3-2-5-10(15)12(9-14)7-4-8-13-12/h4,7-9H,2-3,5-6H2,1H3
InChIKey QMSVPOJPCGUDRY-UHFFFAOYSA-N
Molecular Weight 237.255 g/mol
SMILES C1(N=CC=C1)(C(=O)CCCCC(=O)OC)C=O
SPLASH splash10-03ed-7920000000-cee4d969af5a5713df46
Source of Spectrum B-46-1473-0
Wiley ID 1239471