| SpectraBase Spectrum ID |
Gm3SzMTc6iY |
| Name |
trans-methyl 3-(3-amino-2-(2,4,5-trifluorophenyl)-3,4-dihydro-2H-chromene-6-yl)benzoate |
| Appearance |
White solid |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C23H18F3NO3 |
| InChI |
InChI=1S/C23H18F3NO3/c1-29-23(28)14-4-2-3-12(7-14)13-5-6-21-15(8-13)9-20(27)22(30-21)16-10-18(25)19(26)11-17(16)24/h2-8,10-11,20,22H,9,27H2,1H3/t20-,22+/m0/s1 |
| InChIKey |
TVVFZUDESZLPTH-RBBKRZOGSA-N |
| Instrument Name |
Waters GCT Premier |
| Ionization Type |
EI positive ion |
| Literature Reference DOI |
10.1002/cjoc.202000342 |
| Molecular Weight |
413.396 g/mol |
| Reported Formula |
C23H18F3NO3 |
| SMILES |
N[C@@]1([C@](Oc2ccc(cc2C1)-c1cc(ccc1)C(OC)=O)(c1c(cc(c(c1)F)F)F)[H])[H] |
| SPLASH |
splash10-03xr-0971200000-3b456139a74470bc05bb |
| Source of Spectrum |
CJC-39-SM61-31c |
| Wiley ID |
1856208 |
