SpectraBase Spectrum ID |
HNhxM2Tlt9v |
Name |
2-(4-Oxo-1,4-dihydrochromeno[4,3-c]pyrazole-1-carbonyl)-3-(thiophen-2-yl)acrylonitrile |
Appearance |
Yellow crystals |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
347.036462333 u |
Formula |
C18H9N3O3S |
InChI |
InChI=1S/C18H9N3O3S/c19-9-11(8-12-4-3-7-25-12)17(22)21-16-13-5-1-2-6-15(13)24-18(23)14(16)10-20-21/h1-8,10H |
InChIKey |
VORXKCFJHQOTOC-UHFFFAOYSA-N |
Instrument Name |
Shimadzu GCMS QP1000EX |
Ionization Type |
EI |
Literature Reference DOI |
10.1002/cbdv.202300706 |
Molecular Weight |
347.348 g/mol |
SMILES |
C1(=O)OC2=C(C=CC=C2)C=2N(N=CC12)C(=O)C(=CC=1SC=CC1)C#N |
SPLASH |
splash10-00e9-0095000000-bb24ac7b363d664427f1 |
Source of Spectrum |
CBD-20-SM35-11 (DOI: 10.1002/cbdv.202300706) |
Wiley ID |
1911320 |