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2H-Pyrrole-5-carbonitrile, 4-bromo-3,4-dihydro-2,2,3-trimethyl-, 1-oxide
SpectraBase Compound ID 3l6aDgDJebd
InChI InChI=1S/C8H11BrN2O/c1-5-7(9)6(4-10)11(12)8(5,2)3/h5,7H,1-3H3
InChIKey QSJPVBJXGRHZLO-UHFFFAOYSA-N
Mol Weight 231.09 g/mol
Molecular Formula C8H11BrN2O
Exact Mass 230.005476 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID K8BfdYcng4E
Name 2H-Pyrrole-5-carbonitrile, 4-bromo-3,4-dihydro-2,2,3-trimethyl-, 1-oxide
CAS Registry Number 58134-19-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H11BrN2O
InChI InChI=1S/C8H11BrN2O/c1-5-7(9)6(4-10)11(12)8(5,2)3/h5,7H,1-3H3
InChIKey QSJPVBJXGRHZLO-UHFFFAOYSA-N
Molecular Weight 231.093 g/mol
SMILES C1(=[N+](C(C(C1Br)C)(C)C)[O-])C#N
SPLASH splash10-0udl-9700000000-d6271e87c96b6ac5d51a
Source of Spectrum B-32-1790-0
Synonyms 3-Bromo-2-cyano-4,5,5-trimethyl-1-pyrroline 1-oxide 4-Bromo-2,2,3-trimethyl-3,4-dihydro-2H-pyrrole-5-carbonitrile 1-oxide
Wiley ID 1231165