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N-(3-n-Butylbiphenyl-2-yl)pyrimidin-2-amine

View entire compound with spectra: 1 MS (GC)

N-(3-n-Butylbiphenyl-2-yl)pyrimidin-2-amine
SpectraBase Compound ID B7fEfs9wRAD
InChI InChI=1S/C20H21N3/c1-2-3-9-17-12-7-13-18(16-10-5-4-6-11-16)19(17)23-20-21-14-8-15-22-20/h4-8,10-15H,2-3,9H2,1H3,(H,21,22,23)
InChIKey DEEKPUOSODAPSQ-UHFFFAOYSA-N
Mol Weight 303.41 g/mol
Molecular Formula C20H21N3
Exact Mass 303.173548 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5sCh5IOAICp
Name N-(3-n-Butylbiphenyl-2-yl)pyrimidin-2-amine
Appearance White solid
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 303.173547688 u
Formula C20H21N3
InChI InChI=1S/C20H21N3/c1-2-3-9-17-12-7-13-18(16-10-5-4-6-11-16)19(17)23-20-21-14-8-15-22-20/h4-8,10-15H,2-3,9H2,1H3,(H,21,22,23)
InChIKey DEEKPUOSODAPSQ-UHFFFAOYSA-N
Instrument Name Finnigan MAT 95
Ionization Type EI
Literature Reference DOI 10.1002/anie.201510743
Reported Formula C20H21N3
SMILES N(C1=C(C=CC=C1C1=CC=CC=C1)CCCC)C1=NC=CC=N1
SPLASH splash10-0002-0092000000-b68312bd2748e6250906
Source of Spectrum ACI-55-SM9-3da (DOI: 10.1002/anie.201510743)
Wiley ID 1895343