| SpectraBase Spectrum ID |
JHKNQBvOgC0 |
| Name |
Trovafloxacin TMS |
| Classification |
Pharmaceutical drug derivative |
| Comments |
Spectrum verified by crosschecking against external libraries (one reference spectrum with similarity >= 99% found); Spectrum verified by independent measurements in external laboratories |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
488.149151638 u |
| Formula |
C23H23F3N4O3Si |
| InChI |
InChI=1S/C23H23F3N4O3Si/c1-34(2,3)28-19-13-8-29(9-14(13)19)22-17(26)7-12-20(31)15(23(32)33)10-30(21(12)27-22)18-5-4-11(24)6-16(18)25/h4-7,10,13-14,19,28H,8-9H2,1-3H3,(H,32,33) |
| InChIKey |
QTUUZQLGWVMPGW-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
488.542 g/mol |
| Nominal Mass |
488 u |
| Quality |
995 |
| Retention Index |
3913 |
| SMILES |
OC(C=1C(C2=C(N(C3=C(C=C(C=C3)F)F)C1)N=C(N1CC3C(C3C1)N[Si](C)(C)C)C(=C2)F)=O)=O |
| SPLASH |
splash10-001i-0310900000-fd1547b4ac288ba651f7 |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
1-(2,4-difluorophenyl)-6-fluoro-4-oxo-7-(6-((trimethylsilyl)amino)-3-azabicyclo[3.1.0]hex-3-yl)-\r1,4-dihydro-1,8-naphthyridine-3-carboxylic acid |
| Technique |
GC/MS |
| Wiley ID |
DD2024_031047 |
