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2H-Pyrrole-5-carbonitrile, 3,4-dihydro-2,2,3-trimethyl-4-oxo-, 1-oxide
SpectraBase Compound ID Ji3iRhyEF0z
InChI InChI=1S/C8H10N2O2/c1-5-7(11)6(4-9)10(12)8(5,2)3/h5H,1-3H3
InChIKey GHBHXEHSTHYBGG-UHFFFAOYSA-N
Mol Weight 166.18 g/mol
Molecular Formula C8H10N2O2
Exact Mass 166.074228 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9dcyydT2xuR
Name 2H-Pyrrole-5-carbonitrile, 3,4-dihydro-2,2,3-trimethyl-4-oxo-, 1-oxide
Alternate Name(s) 2,2,3-trimethyl-4-oxo-3,4-dihydro-2H-pyrrole-5-carbonitrile 1-oxide 2-Cyano-4,5,5-trimethyl-3-oxo-1-pyrroline 1-oxide
CAS Registry Number 58134-25-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H10N2O2
InChI InChI=1S/C8H10N2O2/c1-5-7(11)6(4-9)10(12)8(5,2)3/h5H,1-3H3
InChIKey GHBHXEHSTHYBGG-UHFFFAOYSA-N
Molecular Weight 166.180 g/mol
SMILES C1(=[N+](C(C(C1=O)C)(C)C)[O-])C#N
SPLASH splash10-0603-9300000000-f7486c2f4a5d7bfa915a
Source of Spectrum B-32-1792-0
Wiley ID 1162037