| SpectraBase Spectrum ID |
JL6JrlxcxRK |
| Name |
Benzyl 2-(aminomethyl)-4-methylpentanoate-hydrogen p-toluenesulfonate |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C21H29NO5S |
| InChI |
InChI=1S/C14H21NO2.C7H8O3S/c1-11(2)8-13(9-15)14(16)17-10-12-6-4-3-5-7-12;1-6-2-4-7(5-3-6)11(8,9)10/h3-7,11,13H,8-10,15H2,1-2H3;2-5H,1H3,(H,8,9,10) |
| InChIKey |
KUABVDSWWWEUDA-UHFFFAOYSA-N |
| Molecular Weight |
407.525 g/mol |
| SMILES |
NCC(C(OCc1ccccc1)=O)CC(C)C.OS(c1ccc(C)cc1)(=O)=O |
| SPLASH |
splash10-002f-5910000000-46e8391e50d0771b3629 |
| Source of Spectrum |
H-81-970-12 |
| Synonyms |
benzyl 2-(aminomethyl)-4-methylpentanoate 4-methylbenzenesulfonate |
| Wiley ID |
1372560 |
