| SpectraBase Spectrum ID |
7EwlM9U5C2V |
| Name |
1-(3,5-dimethylphenyl)-4-[(4Z)-4-[(2-sulfanylidenepropyl)imino]-6,8-dioxabicyclo[3.2.1]octan-2-yl]-4,5-dihydro-1H-1,2,3,4-tetrazole-5-thione |
| Copyright |
Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
405.104165226 u |
| Formula |
C16H19N7O2S2 |
| InChI |
InChI=1S/C16H19N7O2S2/c1-8-3-9(2)5-10(4-8)22-16(27)23(21-20-22)12-6-11(18-19-15(17)26)14-24-7-13(12)25-14/h3-5,12-14H,6-7H2,1-2H3,(H3,17,19,26)/b18-11- |
| InChIKey |
FFLINNROFJNWBV-WQRHYEAKSA-N |
| Molecular Weight |
405.495 g/mol |
| NMR Offset |
18.0068 |
| NMR Spectrometer Frequency |
500.134 |
| Observed nucleus |
1H |
| Sample State |
Soluted |
| Sample_ID |
1H_CB_2021_8238 |
| Solvent |
DMSO-d6 |
| Source |
Vendor ID: NMR/13300487; Lab Info: SAD; Lab Number: 016 |
![1-(3,5-dimethylphenyl)-4-[(4Z)-4-[(2-sulfanylidenepropyl)imino]-6,8-dioxabicyclo[3.2.1]octan-2-yl]-4,5-dihydro-1H-1,2,3,4-tetrazole-5-thione](/api/spectrum/7EwlM9U5C2V/structure.png?h=300&w=458 "1-(3,5-dimethylphenyl)-4-[(4Z)-4-[(2-sulfanylidenepropyl)imino]-6,8-dioxabicyclo[3.2.1]octan-2-yl]-4,5-dihydro-1H-1,2,3,4-tetrazole-5-thione")
