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N-(1,4-Dioxan-2-yl)pyrrole-2-carbonitrile
SpectraBase Compound ID 3BaXRzTqH9A
InChI InChI=1S/C9H10N2O2/c10-6-8-2-1-3-11(8)9-7-12-4-5-13-9/h1-3,9H,4-5,7H2
InChIKey QATZGEIVSSFSRY-UHFFFAOYSA-N
Mol Weight 178.19 g/mol
Molecular Formula C9H10N2O2
Exact Mass 178.074228 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GIjTnG8W78f
Name N-(1,4-Dioxan-2-yl)pyrrole-2-carbonitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H10N2O2
InChI InChI=1S/C9H10N2O2/c10-6-8-2-1-3-11(8)9-7-12-4-5-13-9/h1-3,9H,4-5,7H2
InChIKey QATZGEIVSSFSRY-UHFFFAOYSA-N
Literature Reference DOI 10.1002/cssc.201700783
Molecular Weight 178.191 g/mol
SMILES c1([n](ccc1)C1OCCOC1)C#N
SPLASH splash10-000i-9200000000-230a05b46094ddce5f0b
Source of Spectrum CSC-10-3081-24
Synonyms 1-(1,4-dioxan-2-yl)-1H-pyrrole-2-carbonitrile
Wiley ID 1808272