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Acetamide, N-[4-(1-methylethyl)phenyl]-N-[5-[6-(3-pyridinyl)hexyl]-2-pyridinyl]-
SpectraBase Compound ID 4A8VasSzqAe
InChI InChI=1S/C27H33N3O/c1-21(2)25-13-15-26(16-14-25)30(22(3)31)27-17-12-24(20-29-27)10-7-5-4-6-9-23-11-8-18-28-19-23/h8,11-21H,4-7,9-10H2,1-3H3
InChIKey YJPDRMGNQWDAKW-UHFFFAOYSA-N
Mol Weight 415.6 g/mol
Molecular Formula C27H33N3O
Exact Mass 415.262363 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HUEHdJLO1Aq
Name Acetamide, N-[4-(1-methylethyl)phenyl]-N-[5-[6-(3-pyridinyl)hexyl]-2-pyridinyl]-
CAS Registry Number 107962-17-4
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C27H33N3O
InChI InChI=1S/C27H33N3O/c1-21(2)25-13-15-26(16-14-25)30(22(3)31)27-17-12-24(20-29-27)10-7-5-4-6-9-23-11-8-18-28-19-23/h8,11-21H,4-7,9-10H2,1-3H3
InChIKey YJPDRMGNQWDAKW-UHFFFAOYSA-N
Molecular Weight 415.581 g/mol
SMILES c1(N(C(=O)C)c2ccc(cc2)C(C)C)ncc(cc1)CCCCCCc1cnccc1
SPLASH splash10-00di-0009300000-f5918f979b2ccfc02c43
Source of Spectrum J-52-2473-20
Synonyms N-(4-isopropylphenyl)-N-{5-[6-(3-pyridinyl)hexyl]-2-pyridinyl}acetamide N-[4-(1-methylethyl)phenyl]-N-[5-[6-(3-pyridinyl)hexyl]-2-pyridinyl]acetamide
Wiley ID 1376078