| SpectraBase Spectrum ID |
GW73KAg1u1A |
| Name |
1,3,5-Trimethoxy-2-[2-nitroethenyl]benzene |
| CAS Registry Number |
216433-58-8 |
| Classification |
Designer drug precursor |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
239.079372518 u |
| Formula |
C11H13NO5 |
| InChI |
InChI=1S/C11H13NO5/c1-15-8-6-10(16-2)9(4-5-12(13)14)11(7-8)17-3/h4-7H,1-3H3/b5-4+ |
| InChIKey |
URHPFHDNYKOMAI-SNAWJCMRSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
239.227 g/mol |
| Nominal Mass |
239 u |
| Quality |
987 |
| Retention Index |
2235 |
| SMILES |
C1(=C(C=C(C=C1OC)OC)OC)\C=C\[N+](=O)[O-] |
| SPLASH |
splash10-000f-3920000000-ef618941c5707e882f7f |
| Sample Comments |
cis/trans isomerism uncertain |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
2,4,6-Trimethoxy-b-nitrostyrene
1,3,5-Trimethoxy-2-[-2-nitrovinyl]benzene |
| Technique |
GC/MS |
| Wiley ID |
DD2024_024307 |
