SpectraBase Spectrum ID |
2XPvtPwqDOV |
Name |
(3Z)-4-[1'-(2"-Oxopropyl)isoquinolin-2(1H)-yl]but-3-en-2-one |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C16H17NO2 |
InChI |
InChI=1S/C16H17NO2/c1-12(18)7-9-17-10-8-14-5-3-4-6-15(14)16(17)11-13(2)19/h3-10,16H,11H2,1-2H3/b9-7- |
InChIKey |
TVQTWYLFSRJVOO-CLFYSBASSA-N |
Molecular Weight |
255.317 g/mol |
SMILES |
C1(N(C=Cc2ccccc12)\C=C/C(=O)C)CC(=O)C |
SPLASH |
splash10-002e-5950000000-223de334451fd8e272d7 |
Source of Spectrum |
H-91-848-2f |
Wiley ID |
1693303 |