| SpectraBase Spectrum ID |
3RXOg9cXc7u |
| Name |
trans-6-(3-(methylsulfonyl)phenyl)-2-(2,4,5-trifluorophenyl)-3,4-dihydro-2H-chromene-3-amine |
| Appearance |
White solid |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C22H18F3NO3S |
| InChI |
InChI=1S/C22H18F3NO3S/c1-30(27,28)15-4-2-3-12(8-15)13-5-6-21-14(7-13)9-20(26)22(29-21)16-10-18(24)19(25)11-17(16)23/h2-8,10-11,20,22H,9,26H2,1H3/t20-,22+/m0/s1 |
| InChIKey |
VQBQJBAFTGHROY-RBBKRZOGSA-N |
| Instrument Name |
Waters GCT Premier |
| Ionization Type |
EI positive ion |
| Literature Reference DOI |
10.1002/cjoc.202000342 |
| Molecular Weight |
433.445 g/mol |
| Reported Formula |
C22H18F3NO3S |
| SMILES |
N[C@@]1([C@](Oc2ccc(cc2C1)-c1cc(ccc1)S(C)(=O)=O)(c1c(cc(c(c1)F)F)F)[H])[H] |
| SPLASH |
splash10-01p9-0970200000-ef3f06e26c9b8c7256b9 |
| Source of Spectrum |
CJC-39-SM59-31b |
| Wiley ID |
1856207 |
