SpectraBase Spectrum ID |
K1MLXS6BBGe |
Name |
alanine, 2-[(3-ethyl-3-oxetanyl)methoxy]-3,3,3-trifluoro-N-(4-methoxybenzoyl)-, ethyl ester |
Copyright |
Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
419.155571980 u |
Formula |
C19H24F3NO6 |
InChI |
InChI=1S/C19H24F3NO6/c1-4-17(10-27-11-17)12-29-18(19(20,21)22,16(25)28-5-2)23-15(24)13-6-8-14(26-3)9-7-13/h6-9H,4-5,10-12H2,1-3H3,(H,23,24) |
InChIKey |
GQCGTXANJCXGEY-UHFFFAOYSA-N |
Molecular Weight |
419.397 g/mol |
NMR Offset |
14.5168 |
NMR Spectrometer Frequency |
300.133 |
Observed nucleus |
1H |
Sample State |
Soluted |
Sample_ID |
1H_CB_2017_178 |
Solvent |
CDCl3 |
Source |
Vendor ID: ZI/8099123; Lab Info: AU; Lab Number: AU-0002304 |
Temperature |
23.85 °C |