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1-{4-[5-methyl-2-(propan-2-yl)phenoxy]butyl}-1H-1,3-benzodiazole
SpectraBase Compound ID KhjFNqaTLIq
InChI InChI=1S/C21H26N2O/c1-16(2)18-11-10-17(3)14-21(18)24-13-7-6-12-23-15-22-19-8-4-5-9-20(19)23/h4-5,8-11,14-16H,6-7,12-13H2,1-3H3
InChIKey SDMDKFSRZLSIMB-UHFFFAOYSA-N
Mol Weight 322.45 g/mol
Molecular Formula C21H26N2O
Exact Mass 322.204513 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID qbkNjfiLJG
Name 1-{4-[5-methyl-2-(propan-2-yl)phenoxy]butyl}-1H-1,3-benzodiazole
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H26N2O
InChI InChI=1S/C21H26N2O/c1-16(2)18-11-10-17(3)14-21(18)24-13-7-6-12-23-15-22-19-8-4-5-9-20(19)23/h4-5,8-11,14-16H,6-7,12-13H2,1-3H3
InChIKey SDMDKFSRZLSIMB-UHFFFAOYSA-N
Molecular Weight 322.452 g/mol
SMILES c1ccc2[n](cnc2c1)CCCCOc1cc(ccc1C(C)C)C
SPLASH splash10-00e9-2901000000-b0d13e3b63e0bda0c1d9
Source of Spectrum IY-2-5107-9
Synonyms 1H-1,3-Benzimidazole, 1-[4-[5-methyl-2-(1-methylethyl)phenoxy]butyl]- 1-[4-(5-methyl-2-propan-2-ylphenoxy)butyl]benzimidazole 1-[4-(5-methyl-2-propan-2-yl-phenoxy)butyl]benzimidazole
Wiley ID 1659062