| SpectraBase Spectrum ID |
IEWqKXVvPPy |
| Name |
Pyrimido[1,2-a]azepinium, 4,6,7,8,9,10-hexahydro-2-hydroxy-3-methyl-4-oxo-1-phenyl-, hydroxide, inner salt |
| CAS Registry Number |
101530-75-0 |
| Copyright |
Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C16H18N2O2 |
| InChI |
InChI=1S/C16H18N2O2/c1-12-15(19)17-11-7-3-6-10-14(17)18(16(12)20)13-8-4-2-5-9-13/h2,4-5,8-9H,3,6-7,10-11H2,1H3 |
| InChIKey |
ZNXURKIGZRAVHO-UHFFFAOYSA-N |
| Molecular Weight |
270.332 g/mol |
| SMILES |
C12=[N+](C(C(=C(N2c2ccccc2)[O-])C)=O)CCCCC1 |
| SPLASH |
splash10-003r-9220000000-7a73e5bcb4419d932a19 |
| Source of Spectrum |
K-118-4572-6 |
| Synonyms |
2-Anilino-4,5,6,7-tetrahydro-3H-azepin
3-Methyl-4-oxo-1-phenyl-1H,4H,6H,7H,8H,9H,10H-pyrimido[1,2-a]azepin-5-ium-2-olate |
| Wiley ID |
1274428 |
![Pyrimido[1,2-a]azepinium, 4,6,7,8,9,10-hexahydro-2-hydroxy-3-methyl-4-oxo-1-phenyl-, hydroxide, inner salt](/api/spectrum/IEWqKXVvPPy/structure.png?h=300&w=458 "Pyrimido[1,2-a]azepinium, 4,6,7,8,9,10-hexahydro-2-hydroxy-3-methyl-4-oxo-1-phenyl-, hydroxide, inner salt")
