| SpectraBase Spectrum ID |
OzhWbhpG7m |
| Name |
2-Butenoic acid, 4-[[2-[(4-bromophenyl)ethynyl]phenyl]amino]-4-oxo-, (2Z)- |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
369.000056247 u |
| Formula |
C18H12BrNO3 |
| InChI |
InChI=1S/C18H12BrNO3/c19-15-9-6-13(7-10-15)5-8-14-3-1-2-4-16(14)20-17(21)11-12-18(22)23/h1-4,6-7,9-12H,(H,20,21)(H,22,23)/b12-11- |
| InChIKey |
CMZACEALZURUGE-QXMHVHEDSA-N |
| Molecular Weight |
370.202 g/mol |
| SMILES |
N(C=1C(C#CC=2C=CC(=CC2)Br)=CC=CC1)C(\C=C/C(=O)O)=O |
![2-butenoic acid, 4-[[2-[(4-bromophenyl)ethynyl]phenyl]amino]-4-oxo-, (2Z)-](/api/spectrum/OzhWbhpG7m/structure.png?h=300&w=458 "2-butenoic acid, 4-[[2-[(4-bromophenyl)ethynyl]phenyl]amino]-4-oxo-, (2Z)-")
