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3-methyl-5-(2-methylpropyl)-2H-pyrrole; butane-2,3-dione

View entire compound with spectra: 1 NMR

3-methyl-5-(2-methylpropyl)-2H-pyrrole; butane-2,3-dione
SpectraBase Compound ID ANFU3ToY4wD
InChI InChI=1S/C7H13N3.C2H2O4/c1-5(8)3-7-4-6(2)9-10-7;3-1(4)2(5)6/h4-5H,3,8H2,1-2H3,(H,9,10);(H,3,4)(H,5,6)
InChIKey FHNZDWGXPQPAGD-UHFFFAOYSA-N
Mol Weight 229.24 g/mol
Molecular Formula C9H15N3O4
Exact Mass 229.106256 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 1VmZGiutMeG
Name 3-methyl-5-(2-methylpropyl)-2H-pyrrole; butane-2,3-dione
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 229.106255971 u
Formula C9H15N3O4
InChI InChI=1S/C7H13N3.C2H2O4/c1-5(8)3-7-4-6(2)9-10-7;3-1(4)2(5)6/h4-5H,3,8H2,1-2H3,(H,9,10);(H,3,4)(H,5,6)
InChIKey FHNZDWGXPQPAGD-UHFFFAOYSA-N
Molecular Weight 229.236 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2021_8170
Solvent DMSO-d6
Source Vendor ID: NMR/14210208; Lab Info: L17,Titov; Lab Number: 480