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1H-Pyrrole-3-acetic acid, 2,5-dihydro-4-methyl-2-oxo-, methyl ester
SpectraBase Compound ID 5pZeIwClMAy
InChI InChI=1S/C8H11NO3/c1-5-4-9-8(11)6(5)3-7(10)12-2/h3-4H2,1-2H3,(H,9,11)
InChIKey XGMMDSRDGXVAEI-UHFFFAOYSA-N
Mol Weight 169.18 g/mol
Molecular Formula C8H11NO3
Exact Mass 169.073893 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KbO1khsTlVb
Name 1H-Pyrrole-3-acetic acid, 2,5-dihydro-4-methyl-2-oxo-, methyl ester
Alternate Name(s) Methyl (4-methyl-2-oxo-2,5-dihydro-1H-pyrrol-3-yl)acetate Methyl ester of 4-methyl-2-oxo-3-pyrrolin-3-carboxylic acid
CAS Registry Number 66385-33-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H11NO3
InChI InChI=1S/C8H11NO3/c1-5-4-9-8(11)6(5)3-7(10)12-2/h3-4H2,1-2H3,(H,9,11)
InChIKey XGMMDSRDGXVAEI-UHFFFAOYSA-N
Molecular Weight 169.180 g/mol
SMILES N1CC(=C(C1=O)CC(=O)OC)C
SPLASH splash10-05n0-2900000000-3d0112a7c5d7afb32b31
Source of Spectrum K-111-494-0
Wiley ID 1165692