SpectraBase Compound ID | Bf9VQpyIlzm |
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InChI | InChI=1S/C18H20ClNO5S/c1-2-3-7-16(18(21)22)20-26(23,24)14-11-9-13(10-12-14)25-17-8-5-4-6-15(17)19/h4-6,8-12,16,20H,2-3,7H2,1H3,(H,21,22) |
InChIKey | ZUJWQMYUDFAJIH-UHFFFAOYSA-N |
Mol Weight | 397.87 g/mol |
Molecular Formula | C18H20ClNO5S |
Exact Mass | 397.075072 g/mol |
SpectraBase Spectrum ID | KqkkrlTGkxn |
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Name | N-{[4-(2-chlorophenoxy)phenyl]sulfonyl}norleucine |
Copyright | Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 397.075071617 u |
Formula | C18H20ClNO5S |
InChI | InChI=1S/C18H20ClNO5S/c1-2-3-7-16(18(21)22)20-26(23,24)14-11-9-13(10-12-14)25-17-8-5-4-6-15(17)19/h4-6,8-12,16,20H,2-3,7H2,1H3,(H,21,22) |
InChIKey | ZUJWQMYUDFAJIH-UHFFFAOYSA-N |
Molecular Weight | 397.873 g/mol |
NMR Offset | 18.0068 |
NMR Spectrometer Frequency | 500.134 |
Observed nucleus | 1H |
Sample State | Soluted |
Sample_ID | 1H_CB_2020_2672 |
Solvent | DMSO-d6 |
Source | Vendor ID: NMR/12279777 |