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2-Benzylamino-4-(4-isopropyl-phenyl)-6-(5,6,7,8-tetrahydronaphthalen-2-yl)-nicotinonitrile
SpectraBase Compound ID 3hwcoJo13Ac
InChI InChI=1S/C32H31N3/c1-22(2)24-12-15-26(16-13-24)29-19-31(28-17-14-25-10-6-7-11-27(25)18-28)35-32(30(29)20-33)34-21-23-8-4-3-5-9-23/h3-5,8-9,12-19,22H,6-7,10-11,21H2,1-2H3,(H,34,35)
InChIKey TWBLYHHHGKDKAW-UHFFFAOYSA-N
Mol Weight 457.6 g/mol
Molecular Formula C32H31N3
Exact Mass 457.251798 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1Rlb83kUCW
Name 2-Benzylamino-4-(4-isopropyl-phenyl)-6-(5,6,7,8-tetrahydronaphthalen-2-yl)-nicotinonitrile
Alternate Name(s) 2-[(phenylmethyl)amino]-4-(4-propan-2-ylphenyl)-6-(5,6,7,8-tetrahydronaphthalen-2-yl)-3-pyridinecarbonitrile 2-(benzylamino)-4-(4-propan-2-ylphenyl)-6-(5,6,7,8-tetrahydronaphthalen-2-yl)pyridine-3-carbonitrile 2-(benzylamino)-4-(4-isopropylphenyl)-6-tetralin-6-yl-pyridine-3-carbonitrile 2-[(phenylmethyl)amino]-4-(4-propan-2-ylphenyl)-6-(5,6,7,8-tetrahydronaphthalen-2-yl)pyridine-3-carbonitrile
Comments Less than 3 mono-isotopic peaks
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Formula C32H31N3
InChI InChI=1S/C32H31N3/c1-22(2)24-12-15-26(16-13-24)29-19-31(28-17-14-25-10-6-7-11-27(25)18-28)35-32(30(29)20-33)34-21-23-8-4-3-5-9-23/h3-5,8-9,12-19,22H,6-7,10-11,21H2,1-2H3,(H,34,35)
InChIKey TWBLYHHHGKDKAW-UHFFFAOYSA-N
Molecular Weight 457.621 g/mol
SMILES N(c1c(c(cc(-c2cc3CCCCc3cc2)n1)-c1ccc(cc1)C(C)C)C#N)Cc1ccccc1
SPLASH splash10-0a4i-0000900000-de39c4c7f8aac18b4fb3
Source of Spectrum F2-44-4554-6b
Wiley ID 1714971