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[5-(5,5-Dimethyl-[1,3]dioxan-2-yl)-1H-pyrrol-3-yl]-acetonitrile
SpectraBase Compound ID 8ZCvwjtFhs
InChI InChI=1S/C12H16N2O2/c1-12(2)7-15-11(16-8-12)10-5-9(3-4-13)6-14-10/h5-6,11,14H,3,7-8H2,1-2H3
InChIKey PLSBSZYMRXBUCJ-UHFFFAOYSA-N
Mol Weight 220.27 g/mol
Molecular Formula C12H16N2O2
Exact Mass 220.121178 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Jsw4ZVoNr7W
Name [5-(5,5-DIMETHYL-[1,3]DIOXAN-2-YL)-1H-PYRROL-3-YL]ACETONITRILE
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C12H16N2O2
InChI InChI=1S/C12H16N2O2/c1-12(2)7-15-11(16-8-12)10-5-9(3-4-13)6-14-10/h5-6,11,14H,3,7-8H2,1-2H3
InChIKey PLSBSZYMRXBUCJ-UHFFFAOYSA-N
Molecular Weight 220.1208
SMILES [nH]1c(cc(c1)CC#N)C1OCC(C)(C)CO1
SPLASH splash10-001i-6910000000-821c0863c765deebe675
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany