| SpectraBase Spectrum ID |
2QWA5QwgjtF |
| Name |
1-(5-((5-(4-Chlorophenyl)-1,3,4-oxadiazol-2-yl)imino)-4-phenyl-4,5-dihydro-1,3,4-thiadiazol-2-yl)ethanone |
| Appearance |
Yellowish brown crystals |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
397.040023518 u |
| Formula |
C18H12ClN5O2S |
| InChI |
InChI=1S/C18H12ClN5O2S/c1-11(25)16-23-24(14-5-3-2-4-6-14)18(27-16)20-17-22-21-15(26-17)12-7-9-13(19)10-8-12/h2-10H,1H3 |
| InChIKey |
AJRLRWYVZCPYOX-UHFFFAOYSA-N |
| Instrument Name |
Shimadzu GCMS-QP1000 EX |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/jhet.2250 |
| Molecular Weight |
397.840 g/mol |
| Quality |
186 |
| SMILES |
C1(Cl)=CC=C(C=C1)C1=NN=C(O1)N=C1N(N=C(S1)C(C)=O)C1=CC=CC=C1 |
| SPLASH |
splash10-0002-2396000000-7c04e3311ccadc451dd2 |
| Source of Spectrum |
Y-52-1404-13a (DOI: 10.1002/jhet.2250) |
| Wiley ID |
1902529 |
