| SpectraBase Spectrum ID |
1UA9Q06rENw |
| Name |
1-(phenylmethyl)-5H-triazolo[4,5-b][1,5]benzoxazepin-4-one |
| Alternate Name(s) |
1-(phenylmethyl)-5H-[1,2,3]triazolo[4,5-b][1,5]benzoxazepin-4-one
1-benzyl-5H-triazolo[4,5-b][1,5]benzoxazepin-4-one |
| CAS Registry Number |
106157-41-9 |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C16H12N4O2 |
| InChI |
InChI=1S/C16H12N4O2/c21-15-14-16(22-13-9-5-4-8-12(13)17-15)20(19-18-14)10-11-6-2-1-3-7-11/h1-9H,10H2,(H,17,21) |
| InChIKey |
XHMSIGNROPVNLJ-UHFFFAOYSA-N |
| Molecular Weight |
292.298 g/mol |
| SMILES |
N1c2c(Oc3c(C1=O)nn[n]3Cc1ccccc1)cccc2 |
| SPLASH |
splash10-0006-9020000000-ee6291fe38e1160e5423 |
| Source of Spectrum |
Y-22-1697-10 |
| Wiley ID |
1295300 |
![1-(phenylmethyl)-5H-triazolo[4,5-b][1,5]benzoxazepin-4-one](/api/spectrum/1UA9Q06rENw/structure.png?h=300&w=458 "1-(phenylmethyl)-5H-triazolo[4,5-b][1,5]benzoxazepin-4-one")
