| SpectraBase Spectrum ID |
CIJO31NIQfC |
| Name |
2-benzothiazolecarboxylic acid, 7-nitro-5-[(trifluoromethyl)thio]-,ethyl ester, 3-oxide |
| Copyright |
Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
367.974848165 u |
| Formula |
C11H7F3N2O5S2 |
| InChI |
InChI=1S/C11H7F3N2O5S2/c1-2-21-10(17)9-15(18)6-3-5(23-11(12,13)14)4-7(16(19)20)8(6)22-9/h3-4H,2H2,1H3 |
| InChIKey |
SKTVKDKAGYJPQR-UHFFFAOYSA-N |
| Molecular Weight |
368.301 g/mol |
| NMR Offset |
18.0068 |
| NMR Spectrometer Frequency |
500.134 |
| Observed nucleus |
1H |
| Sample State |
Soluted |
| Sample_ID |
1H_CB_2017_15946 |
| Solvent |
DMSO-d6 |
| Source |
Vendor ID: NMR/10301532; Lab Info: SIP; Lab Number: SIP-0094 |
![2-benzothiazolecarboxylic acid, 7-nitro-5-[(trifluoromethyl)thio]-,ethyl ester, 3-oxide](/api/spectrum/CIJO31NIQfC/structure.png?h=300&w=458 "2-benzothiazolecarboxylic acid, 7-nitro-5-[(trifluoromethyl)thio]-,ethyl ester, 3-oxide")
