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5-(1-hydroxy-2-keto-propyl)-4-keto-2,5-dimethyl-2-pyrroline-3-carbonitrile
SpectraBase Compound ID AhGn8p8Rf3W
InChI InChI=1S/C10H12N2O3/c1-5-7(4-11)9(15)10(3,12-5)8(14)6(2)13/h8,12,14H,1-3H3
InChIKey FZIDXOKSBPDUTE-UHFFFAOYSA-N
Mol Weight 208.22 g/mol
Molecular Formula C10H12N2O3
Exact Mass 208.084792 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KXrT2f4O7VD
Name 2,5-Dimethyl-4-oxidanylidene-5-(1-oxidanyl-2-oxidanylidene-propyl)-1H-pyrrole-3-carbonitrile
CAS Registry Number 127348-17-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H12N2O3
InChI InChI=1S/C10H12N2O3/c1-5-7(4-11)9(15)10(3,12-5)8(14)6(2)13/h8,12,14H,1-3H3
InChIKey FZIDXOKSBPDUTE-UHFFFAOYSA-N
Molecular Weight 208.217 g/mol
SMILES N1C(=C(C(C1(C(C(=O)C)O)C)=O)C#N)C
SPLASH splash10-000i-0920000000-ad13c0085492a4ff4512
Source of Spectrum F-45-6560-10
Synonyms 5-(1-hydroxy-2-keto-propyl)-4-keto-2,5-dimethyl-2-pyrroline-3-carbonitrile 5-(1-hydroxy-2-oxo-propyl)-2,5-dimethyl-4-oxo-1H-pyrrole-3-carbonitrile
Wiley ID 1206424