| SpectraBase Spectrum ID |
CJR7cVtxMvs |
| Name |
beta-alanine, N-(1-methyl-3-nitro-1H-1,2,4-triazol-5-yl)-, 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 |
229.081103850 u |
| Formula |
C7H11N5O4 |
| InChI |
InChI=1S/C7H11N5O4/c1-11-6(8-4-3-5(13)16-2)9-7(10-11)12(14)15/h3-4H2,1-2H3,(H,8,9,10) |
| InChIKey |
JUHZBIAXFVUTCQ-UHFFFAOYSA-N |
| Molecular Weight |
229.196 g/mol |
| NMR Offset |
18.0068 |
| NMR Spectrometer Frequency |
500.134 |
| Observed nucleus |
1H |
| Sample State |
Soluted |
| Sample_ID |
1H_CB_2017_10718 |
| Solvent |
DMSO-d6 |
| Source |
Vendor ID: NMR/10252447; Lab Info: LP; Lab Number: LP-3103099 |
