| SpectraBase Spectrum ID |
16qVrS6zK24 |
| Name |
trans-3-(3-amino-2-(2,4,5-trifluorophenyl)-3,4-dihydro-2H-chromene-6-yl)benzonitrile |
| Appearance |
White solid |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C22H15F3N2O |
| InChI |
InChI=1S/C22H15F3N2O/c23-17-10-19(25)18(24)9-16(17)22-20(27)8-15-7-14(4-5-21(15)28-22)13-3-1-2-12(6-13)11-26/h1-7,9-10,20,22H,8,27H2/t20-,22+/m0/s1 |
| InChIKey |
WEKNSNFGSQFTHK-RBBKRZOGSA-N |
| Instrument Name |
Waters GCT Premier |
| Ionization Type |
EI positive ion |
| Literature Reference DOI |
10.1002/cjoc.202000342 |
| Molecular Weight |
380.370 g/mol |
| Reported Formula |
C22H15F3N2O |
| SMILES |
N[C@@]1([C@](Oc2ccc(cc2C1)-c1cc(ccc1)C#N)(c1c(cc(c(c1)F)F)F)[H])[H] |
| SPLASH |
splash10-01p9-0972000000-d1032e8466353d1eb73b |
| Source of Spectrum |
CJC-39-SM68-31h |
| Wiley ID |
1856213 |
