| SpectraBase Spectrum ID |
DRO1WbwL9X6 |
| Name |
1-Nitro-2-phenylheptan-4-one |
| Comments |
Edited after expert review for CDCl3 contamination - Original record with SpectrumID 1767667 moved to the Legacy library |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C13H17NO3 |
| InChI |
InChI=1S/C13H17NO3/c1-2-6-13(15)9-12(10-14(16)17)11-7-4-3-5-8-11/h3-5,7-8,12H,2,6,9-10H2,1H3 |
| InChIKey |
PVHJOPDNUPIBGU-UHFFFAOYSA-N |
| Literature Reference DOI |
10.1002/adsc.200404037 |
| Molecular Weight |
235.283 g/mol |
| SMILES |
C(C(CC(CN(=O)=O)c1ccccc1)=O)CC |
| SPLASH |
splash10-00di-9600000000-70c17222cc11c64b2c33 |
| Source of Spectrum |
ASC-346-1160-7c |
| Wiley ID |
1821261 |
