| SpectraBase Spectrum ID |
LoLeAbo2s8z |
| Name |
(R*S,S*)-N-(p-Chlorophenyl-)1-phenyl-[1-(2,4,6-triisopropylphenylsulfinyl)-2-naphthyl]methylamine |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
593.251913785 u |
| Formula |
C38H40ClNOS |
| InChI |
InChI=1S/C38H40ClNOS/c1-24(2)29-22-34(25(3)4)38(35(23-29)26(5)6)42(41)37-32-15-11-10-12-27(32)16-21-33(37)36(28-13-8-7-9-14-28)40-31-19-17-30(39)18-20-31/h7-26,36,40H,1-6H3 |
| InChIKey |
QJLXWVKTCHCHOH-UHFFFAOYSA-N |
| Molecular Weight |
594.257 g/mol |
| SMILES |
C1(S(C2=C(C(NC=3C=CC(=CC3)Cl)C=3C=CC=CC3)C=CC3=C2C=CC=C3)=O)=C(C=C(C=C1C(C)C)C(C)C)C(C)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.801862 |
![(R*s,S*)-N-(p-Chlorophenyl-)1-phenyl-[1-(2,4,6-triisopropylphenylsulfinyl)-2-naphthyl]methylamine](/api/spectrum/LoLeAbo2s8z/structure.png?h=300&w=458 "(R*s,S*)-N-(p-Chlorophenyl-)1-phenyl-[1-(2,4,6-triisopropylphenylsulfinyl)-2-naphthyl]methylamine")
