SpectraBase Spectrum ID |
9kyOwf5fJHC |
Name |
1-Nitro-2-phenylheptan-4-one |
Comments |
Removed - expert review: contamination (CH2Cl2); A corrected record has been addded having SpectrumID: 1821261 |
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(C[N+](=O)[O-])c1ccccc1)=O)CC |
SPLASH |
splash10-00e9-9300000000-260ebdff589c140f6665 |
Source of Spectrum |
ASC-346-1160-7c |
Wiley ID |
1767667 |