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N-Methyl-[1-(2,4,6-triisopropylphenylsulfinyl)-2-naphthyl]methanimine
SpectraBase Compound ID HxCeOM4OH7h
InChI InChI=1S/C27H33NOS/c1-17(2)22-14-24(18(3)4)27(25(15-22)19(5)6)30(29)26-21(16-28-7)13-12-20-10-8-9-11-23(20)26/h8-19H,1-7H3/b28-16+
InChIKey SOYTZGRNXQMVRN-LQKURTRISA-N
Mol Weight 419.6 g/mol
Molecular Formula C27H33NOS
Exact Mass 419.228286 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID Ktq6dBO6mV
Name N-Methyl-[1-(2,4,6-triisopropylphenylsulfinyl)-2-naphthyl]methanimine
Comments Computed using SmartSpectra Model v1.42
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Exact Mass 419.228285860 u
Formula C27H33NOS
InChI InChI=1S/C27H33NOS/c1-17(2)22-14-24(18(3)4)27(25(15-22)19(5)6)30(29)26-21(16-28-7)13-12-20-10-8-9-11-23(20)26/h8-19H,1-7H3/b28-16+
InChIKey SOYTZGRNXQMVRN-LQKURTRISA-N
Molecular Weight 419.627 g/mol
SMILES C=1(S(C2=C3C(C=CC=C3)=CC=C2\C=N\C)=O)C(=CC(=CC1C(C)C)C(C)C)C(C)C
Spectrum/Structure Validation Score (Vapor Phase IR) 0.971673