| SpectraBase Spectrum ID |
FodUF2BJNyl |
| Name |
4-hydroxy-2-(4-methylphenyl)-hexahydro-pyrrolo[1,2-a][1,4]diazepine-1,7-dione |
| Appearance |
oil |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
274.131742445 u |
| Formula |
C15H18N2O3 |
| InChI |
InChI=1S/C15H18N2O3/c1-10-2-4-11(5-3-10)16-8-12(18)9-17-13(15(16)20)6-7-14(17)19/h2-5,12-13,18H,6-9H2,1H3 |
| InChIKey |
MYEBCWISJHGKRE-UHFFFAOYSA-N |
| Instrument Name |
MAT 700 ITD, Varian MAT 311 |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1186/1860-5397-3-28 |
| Molecular Weight |
274.320 g/mol |
| Quality |
434 |
| Reported Formula |
C15H18N2O3 |
| SMILES |
OC1CN2C(CCC2C(=O)N(C1)C=1C=CC(=CC1)C)=O |
| SPLASH |
splash10-00dl-9810000000-88abad56032b4a955c0f |
| Sample Comments |
Mixture of diastereoisomers = (30:70) |
| Source of Spectrum |
BJO-3-SM5-8b (DOI: 10.1186/1860-5397-3-28) |
| Thin-Layer Chromatography |
0.12 (silica/ethyl acetate) |
| Wiley ID |
1908966 |
![4-hydroxy-2-(4-methylphenyl)-hexahydro-pyrrolo[1,2-a][1,4]diazepine-1,7-dione](/api/spectrum/FodUF2BJNyl/structure.png?h=300&w=458 "4-hydroxy-2-(4-methylphenyl)-hexahydro-pyrrolo[1,2-a][1,4]diazepine-1,7-dione")
