SpectraBase Spectrum ID |
JSsdaAL2dl6 |
Name |
N-(3,6-dioxo-4-[propylamino]cyclohexa-1,4-dien-1-yl)acetamide |
Appearance |
Purple-color solid powder |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C11H14N2O3 |
InChI |
InChI=1S/C11H14N2O3/c1-3-4-12-8-5-11(16)9(6-10(8)15)13-7(2)14/h5-6,12H,3-4H2,1-2H3,(H,13,14) |
InChIKey |
WTNWZLLDGYONEI-UHFFFAOYSA-N |
Instrument Name |
Agilent 5890-5972 or JOEL JMS SX/SX 102A |
Ionization Type |
EI positive ion |
Literature Reference DOI |
10.1002/jccs.202000122 |
Molecular Weight |
222.244 g/mol |
Reported Formula |
C11H14N2O3 |
SMILES |
N(C(C)=O)C1=CC(C(=CC1=O)NCCC)=O |
SPLASH |
splash10-0ul0-2930000000-d34dbae33010d9dc7b21 |
Source of Spectrum |
QA-67-SM31-4b |
Wiley ID |
1856313 |