| SpectraBase Spectrum ID |
J2MOFvZ8cjV |
| Name |
propanoic acid, 3-[[3-(1,3-dioxolan-2-yl)-6-nitro-1,2-benzisoxazol-4-yl]thio]-, 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 |
354.052171966 u |
| Formula |
C14H14N2O7S |
| InChI |
InChI=1S/C14H14N2O7S/c1-20-11(17)2-5-24-10-7-8(16(18)19)6-9-12(10)13(15-23-9)14-21-3-4-22-14/h6-7,14H,2-5H2,1H3 |
| InChIKey |
YAAUPGARPCNNAF-UHFFFAOYSA-N |
| Molecular Weight |
354.333 g/mol |
| NMR Offset |
18.0068 |
| NMR Spectrometer Frequency |
500.134 |
| Observed nucleus |
1H |
| Sample State |
Soluted |
| Sample_ID |
1H_CB_2017_14921 |
| Solvent |
DMSO-d6 |
| Source |
Vendor ID: NMR/11210267; Lab Info: DAL; Lab Number: DAL-vin0007 |
![3-[[3-(1,3-dioxolan-2-yl)-6-nitro-1,2-benzoxazol-4-yl]thio]propanoic acid methyl ester](/api/spectrum/J2MOFvZ8cjV/structure.png?h=300&w=458 "3-[[3-(1,3-dioxolan-2-yl)-6-nitro-1,2-benzoxazol-4-yl]thio]propanoic acid methyl ester")
