| SpectraBase Spectrum ID |
8fmQblxFjN |
| Name |
alanine, N-benzoyl-2-[[4-(chlorodifluoromethoxy)phenyl]amino]-3,3,3-trifluoro-, methyl 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 |
452.056225450 u |
| Formula |
C18H14ClF5N2O4 |
| InChI |
InChI=1S/C18H14ClF5N2O4/c1-29-15(28)16(17(20,21)22,26-14(27)11-5-3-2-4-6-11)25-12-7-9-13(10-8-12)30-18(19,23)24/h2-10,25H,1H3,(H,26,27) |
| InChIKey |
KCMPZDRPWUKMKK-UHFFFAOYSA-N |
| Molecular Weight |
452.765 g/mol |
| NMR Offset |
18.0068 |
| NMR Spectrometer Frequency |
500.134 |
| Observed nucleus |
1H |
| Sample State |
Soluted |
| Sample_ID |
1H_CB_2017_12208 |
| Solvent |
DMSO-d6 |
| Source |
Vendor ID: NMR/10260707; Lab Info: AU; Lab Number: AU-0000034 |
![alanine, N-benzoyl-2-[[4-(chlorodifluoromethoxy)phenyl]amino]-3,3,3-trifluoro-, methyl ester](/api/spectrum/8fmQblxFjN/structure.png?h=300&w=458 "alanine, N-benzoyl-2-[[4-(chlorodifluoromethoxy)phenyl]amino]-3,3,3-trifluoro-, methyl ester")
