SpectraBase Spectrum ID |
HQSiZoz7kWH |
Name |
N-{[4-(2-chlorophenoxy)phenyl]sulfonyl}(methyl)homocysteine |
Copyright |
Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
415.031492727 u |
Formula |
C17H18ClNO5S2 |
InChI |
InChI=1S/C17H18ClNO5S2/c1-25-11-10-15(17(20)21)19-26(22,23)13-8-6-12(7-9-13)24-16-5-3-2-4-14(16)18/h2-9,15,19H,10-11H2,1H3,(H,20,21) |
InChIKey |
VVLBKESFOSFQRN-UHFFFAOYSA-N |
Molecular Weight |
415.906 g/mol |
NMR Offset |
18.0068 |
NMR Spectrometer Frequency |
500.134 |
Observed nucleus |
1H |
Sample State |
Soluted |
Sample_ID |
1H_CB_2020_2673 |
Solvent |
DMSO-d6 |
Source |
Vendor ID: NMR/12279778 |