SpectraBase Spectrum ID |
64HeEHgqeTP |
Name |
1-(4-Methoxyphenyl)-3-nitropent-3-en-1-one |
Appearance |
Pale yellow solid |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C12H13NO4 |
InChI |
InChI=1S/C12H13NO4/c1-3-10(13(15)16)8-12(14)9-4-6-11(17-2)7-5-9/h3-7H,8H2,1-2H3 |
InChIKey |
PFQCNPXJZWUUGV-UHFFFAOYSA-N |
Instrument Name |
Hewlett Packard 6890N |
Ionization Type |
EI |
Literature Reference DOI |
10.1002/adsc.202000747 |
Molecular Weight |
235.239 g/mol |
SMILES |
C(CC(=CC)[N+](=O)[O-])(=O)c1ccc(cc1)OC |
SPLASH |
splash10-000i-1900000000-c42bd3b75faa094a1900 |
Sample Comments |
E/Z = 90:10 |
Source of Spectrum |
ASC-362-4684-2d |
Wiley ID |
1855599 |