SpectraBase Spectrum ID |
11moYbnXPOZ |
Name |
Dimethyl [(1S)-1-{[(S)-(tert-Butyl)sulfinyl]amino}-3-phenylpropyl]propanedioate |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C18H27NO5S |
InChI |
InChI=1S/C18H27NO5S/c1-18(2,3)25(22)19-14(12-11-13-9-7-6-8-10-13)15(16(20)23-4)17(21)24-5/h6-10,14-15,19H,11-12H2,1-5H3/t14-,25?/m0/s1 |
InChIKey |
SJUBYKNCWYIFTN-GQBYZMJGSA-N |
Literature Reference DOI |
10.1002/hlca.201200303 |
Molecular Weight |
369.476 g/mol |
SMILES |
N([S@@](=O)C(C)(C)C)[C@@](CCc1ccccc1)(C(C(=O)OC)C(=O)OC)[H] |
SPLASH |
splash10-002f-5920000000-8ce9e425c991ed91c44b |
Source of Spectrum |
H-95-1796-ent_3c |
Synonyms |
Dimethyl 2-((S)-1-(((S)-tert-butylsulfinyl)amino)-3-phenylpropyl)malonate |
Wiley ID |
1784181 |