SpectraBase Spectrum ID |
Ktq6dBO6mV |
Name |
N-Methyl-[1-(2,4,6-triisopropylphenylsulfinyl)-2-naphthyl]methanimine |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
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 |