| SpectraBase Spectrum ID |
IjhVdfUgcaV |
| Name |
benzoic acid, 4-[(E)-(6,7,8,9-tetrahydro-3-oxo-3H-imidazo[1,2-a]azepin-2(5H)-ylidene)methyl]-, 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 |
298.131742445 u |
| Formula |
C17H18N2O3 |
| InChI |
InChI=1S/C17H18N2O3/c1-22-17(21)13-8-6-12(7-9-13)11-14-16(20)19-10-4-2-3-5-15(19)18-14/h6-9,11H,2-5,10H2,1H3/b14-11+ |
| InChIKey |
KZZVGTFNIUAIEA-SDNWHVSQSA-N |
| Molecular Weight |
298.342 g/mol |
| NMR Offset |
18.0068 |
| NMR Spectrometer Frequency |
500.134 |
| Observed nucleus |
1H |
| Sample State |
Soluted |
| Sample_ID |
1H_CB_2017_6121 |
| Solvent |
DMSO-d6 |
| Source |
Vendor ID: NMR/11211114; Lab Info: DEM; Lab Number: 0482 |
![benzoic acid, 4-[(E)-(6,7,8,9-tetrahydro-3-oxo-3H-imidazo[1,2-a]azepin-2(5H)-ylidene)methyl]-, methyl ester](/api/spectrum/IjhVdfUgcaV/structure.png?h=300&w=458 "benzoic acid, 4-[(E)-(6,7,8,9-tetrahydro-3-oxo-3H-imidazo[1,2-a]azepin-2(5H)-ylidene)methyl]-, methyl ester")
