| SpectraBase Spectrum ID |
D3ZTRSM01BX |
| Name |
(3S,rs)-N-(Tert-butoxycarbonyl)-3-amino-5-methyl-1-(p-tolylsulfinyl)-2-hexanone |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
367.181729588 u |
| Formula |
C19H29NO4S |
| InChI |
InChI=1S/C19H29NO4S/c1-13(2)11-16(20-18(22)24-19(4,5)6)17(21)12-25(23)15-9-7-14(3)8-10-15/h7-10,13,16H,11-12H2,1-6H3,(H,20,22)/t16-,25?/m0/s1 |
| InChIKey |
ZTDHZNSFQWXAEO-YPHZTSLFSA-N |
| Molecular Weight |
367.504 g/mol |
| SMILES |
C(S(C1=CC=C(C=C1)C)=O)C([C@@](NC(OC(C)(C)C)=O)(CC(C)C)[H])=O |
