| SpectraBase Spectrum ID |
2l6rkqBJlB2 |
| Name |
Zearalenone |
| CAS Registry Number |
17924-92-4 |
| Classification |
Estrogenic mycotoxin |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
318.146723803 u |
| Formula |
C18H22O5 |
| InChI |
InChI=1S/C18H22O5/c1-12-6-5-9-14(19)8-4-2-3-7-13-10-15(20)11-16(21)17(13)18(22)23-12/h3,7,10-12,20-21H,2,4-6,8-9H2,1H3/b7-3+/t12-/m0/s1 |
| InChIKey |
MBMQEIFVQACCCH-QBODLPLBSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
318.369 g/mol |
| Nominal Mass |
318 u |
| Quality |
814 |
| Retention Index |
2399 |
| SMILES |
OC=1C2=C(C=C(C1)O)\C=C\CCCC(CCC[C@@](OC2=O)(C)[H])=O |
| SPLASH |
splash10-05mo-9600000000-54e9c5092a1aceaaaa26 |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
(2E,11S)-15,17-Dihydroxy-11-methyl-12-oxabicyclo[12.4.0]octadeca-1(18),2,14,16-tetraene-7,13-dione |
| Technique |
GC/MS |
| Wiley ID |
DD2024_012844 |
