| SpectraBase Spectrum ID |
KcvlHnvqFRT |
| Name |
N-(3-methyl-1,3-butadienyl)-1,3,4,5,6,7-hexahydro-2H-azepin-7-one |
| CAS Registry Number |
112682-85-6 |
| Copyright |
Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C11H17NO |
| InChI |
InChI=1S/C11H17NO/c1-10(2)7-9-12-8-5-3-4-6-11(12)13/h7,9H,1,3-6,8H2,2H3/b9-7+ |
| InChIKey |
XEIQOGNCVUEICG-VQHVLOKHSA-N |
| Molecular Weight |
179.263 g/mol |
| SMILES |
C1(N(CCCCC1)\C=C\C(=C)C)=O |
| SPLASH |
splash10-052o-9200000000-0adde431e3baae6baa49 |
| Source of Spectrum |
J-53-1165-10 |
| Synonyms |
1-[(1E)-3-methyl-1,3-butadienyl]hexahydro-2H-azepin-2-one |
| Wiley ID |
1175419 |
