| SpectraBase Spectrum ID |
J85f9pFmN6Z |
| Name |
(S)-7-(1-Carboxyethylamino)-1-cyclopropyl-8-fluoro-6-nitro-4-oxo-1,4-dihydroquinoline-3-carboxylic acid |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C16H14FN3O7 |
| InChI |
InChI=1S/C16H14FN3O7/c1-6(15(22)23)18-12-10(20(26)27)4-8-13(11(12)17)19(7-2-3-7)5-9(14(8)21)16(24)25/h4-7,18H,2-3H2,1H3,(H,22,23)(H,24,25)/t6-/m0/s1 |
| InChIKey |
IGJRVXMMRYAAAF-LURJTMIESA-N |
| Instrument Name |
Finnigan MAT TSQ-70?? |
| Ionization Type |
EI |
| Molecular Weight |
379.300 g/mol |
| Reported Formula |
C16H14FN3O7 |
| SMILES |
OC(C=1C(c2c(c(c(c(c2)[N+]([O-])=O)N[C@](C(=O)O)(C)[H])F)N(C1)C1CC1)=O)=O |
| SPLASH |
splash10-01ox-4193000000-220c5073369adaa26d0b |
| Source of Spectrum |
EP1721898B1 |
| Wiley ID |
1861540 |
