SpectraBase Spectrum ID |
LSBxNql9bt3 |
Name |
(E)-1-(2,4,5-Trimethoxyphenyl)-2-nitroprop-1-ene |
Classification |
Designer drug precursor |
Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
Exact Mass |
253.095022582 u |
Formula |
C12H15NO5 |
InChI |
InChI=1S/C12H15NO5/c1-8(13(14)15)5-9-6-11(17-3)12(18-4)7-10(9)16-2/h5-7H,1-4H3/b8-5+ |
InChIKey |
YJLWVSYNZFMHTK-VMPITWQZSA-N |
Ionization Type |
Electron Ionization (EI) |
Molecular Weight |
253.254 g/mol |
Nominal Mass |
253 u |
Quality |
972 |
Retention Index |
1877 |
SMILES |
C=1(C(=CC(=C(C1)OC)OC)OC)\C=C/([N+](=O)[O-])C |
SPLASH |
splash10-0zfu-5950000000-b859925f8a6aed9cff56 |
Source of Spectrum |
DigiLab GmbH (C) 2024 |
Synonyms |
1,2,4-trimethoxy-5-[(1E)-2-nitroprop-1-en-1-yl]benzene |
Technique |
GC/MS |
Wiley ID |
DD2024_004172 |