| SpectraBase Spectrum ID |
6lX501gycg8 |
| Name |
Ethyl (1S,2S)-2-methyl-2-(6-(trifluoromethyl)pyridin-3-yl)cyclopropane-1-carboxylate |
| Appearance |
Colorless oil |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
273.097663182 u |
| Formula |
C13H14F3NO2 |
| GC Column |
RTX-XLB (30 m ?? 0.25 mm, film thickness 0.28 micrometer) |
| GC Oven Program |
Oven temp 290oC |
| InChI |
InChI=1S/C13H14F3NO2/c1-3-19-11(18)9-6-12(9,2)8-4-5-10(17-7-8)13(14,15)16/h4-5,7,9H,3,6H2,1-2H3/t9-,12-/m1/s1 |
| InChIKey |
AZJSBEYEWMJLGO-BXKDBHETSA-N |
| Instrument Name |
Shimadzu GCMS-QP2010 |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/anie.201608680 |
| Molecular Weight |
273.255 g/mol |
| SMILES |
C1(=CC=C(C=N1)[C@]1(C[C@@]1(C(=O)OCC)[H])C)C(F)(F)F |
| SPLASH |
splash10-0udi-0090000000-48a3ffd6201ae0c1aae5 |
| Sample Comments |
>99.9% de, >99.9% ee |
| Source of Spectrum |
ACI-55-SM44-23 (DOI: 10.1002/anie.201608680) |
| Wiley ID |
1899402 |
