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5-(2-(4-(1,3-Dioxolan-2-yl)butyl)-5-methoxyphenyl)-1H-pyrrole-3-carbonitrile
SpectraBase Compound ID LMPCHkHr58H
InChI InChI=1S/C19H22N2O3/c1-22-16-7-6-15(4-2-3-5-19-23-8-9-24-19)17(11-16)18-10-14(12-20)13-21-18/h6-7,10-11,13,19,21H,2-5,8-9H2,1H3
InChIKey QVJCDGGQAUMKRW-UHFFFAOYSA-N
Mol Weight 326.4 g/mol
Molecular Formula C19H22N2O3
Exact Mass 326.163043 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9M3JKrAldZD
Name 5-(2-(4-(1,3-Dioxolan-2-yl)butyl)-5-methoxyphenyl)-1H-pyrrole-3-carbonitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H22N2O3
InChI InChI=1S/C19H22N2O3/c1-22-16-7-6-15(4-2-3-5-19-23-8-9-24-19)17(11-16)18-10-14(12-20)13-21-18/h6-7,10-11,13,19,21H,2-5,8-9H2,1H3
InChIKey QVJCDGGQAUMKRW-UHFFFAOYSA-N
Literature Reference DOI 10.1021/acs.orglett.6b00141
Molecular Weight 326.396 g/mol
SMILES [nH]1c(cc(c1)C#N)-c1c(ccc(c1)OC)CCCCC1OCCO1
SPLASH splash10-024i-5093000000-b47c0de18526b2002bae
Source of Spectrum A1-18-852/SM19-4f
Wiley ID 1805206