| SpectraBase Spectrum ID |
5Egh8Inbjbb |
| Name |
2,4-Cyclohexadien-1-one, 6-[(2-azidophenyl)methyl]-2,4,6-trimethyl- |
| Alternate Name(s) |
5,6,6a,7,9a,9b-hexahydro-7-oxo-4,8,9a-trimethyl-4H-1,2,3-triazolo(4,5,1-ij)benz(b)quinoline
6-(2-azidobenzyl)-2,4,6-trimethyl-2,4-cyclohexadien-1-one |
| CAS Registry Number |
85202-96-6 |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C16H17N3O |
| InChI |
InChI=1S/C16H17N3O/c1-11-8-12(2)15(20)16(3,9-11)10-13-6-4-5-7-14(13)18-19-17/h4-9H,10H2,1-3H3 |
| InChIKey |
MPQVUUFLJYHUHK-UHFFFAOYSA-N |
| Molecular Weight |
267.332 g/mol |
| SMILES |
C1(C(C(C)=CC(=C1)C)=O)(Cc1c(N=[N+]=[N-])cccc1)C |
| SPLASH |
splash10-0002-0900000000-2c42115465f160ff938c |
| Source of Spectrum |
C-105-3277-0 |
| Wiley ID |
1271268 |
![2,4-Cyclohexadien-1-one, 6-[(2-azidophenyl)methyl]-2,4,6-trimethyl-](/api/spectrum/5Egh8Inbjbb/structure.png?h=300&w=458 "2,4-Cyclohexadien-1-one, 6-[(2-azidophenyl)methyl]-2,4,6-trimethyl-")
