SpectraBase Spectrum ID |
JEQ5wBAaekS |
Name |
Amoxicillin 2TMS (O-ester,N) |
Classification |
Pharmaceutical drug derivative |
Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
Exact Mass |
509.183595478 u |
Formula |
C22H35N3O5SSi2 |
InChI |
InChI=1S/C22H35N3O5SSi2/c1-22(2)17(21(29)30-33(6,7)8)25-19(28)16(20(25)31-22)23-18(27)15(24-32(3,4)5)13-9-11-14(26)12-10-13/h9-12,15-17,20,24,26H,1-8H3,(H,23,27)/t15-,16-,17+,20-/m1/s1 |
InChIKey |
OKHUBQIQPMHPJX-PDOICOKGSA-N |
Ionization Type |
Electron Ionization (EI) |
Molecular Weight |
509.768 g/mol |
Nominal Mass |
509 u |
Quality |
1000 |
Retention Index |
3789 |
SMILES |
OC1=CC=C([C@](C(N[C@]2([C@@]3(N(C2=O)[C@](C(S3)(C)C)(C(O[Si](C)(C)C)=O)[H])[H])[H])=O)(N[Si](C)(C)C)[H])C=C1 |
SPLASH |
splash10-0006-2910000000-bcf0aaec16828ae89b19 |
Source of Spectrum |
DigiLab GmbH (C) 2024 |
Synonyms |
Trimethylsilyl (2R,5S,6S)-6-(((2S)-2-(4-hydroxyphenyl)-2-((trimethylsilyl)amino)ethanoyl)amino)-\r3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate |
Technique |
GC/MS |
Wiley ID |
DD2024_030401 |