SpectraBase Spectrum ID |
JGBor9k7auO |
Name |
1-(4-Propylthio-2,5-dimethoxyphenyl)-2-nitroprop-1-ene |
Classification |
Designer drug precursor |
Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
Exact Mass |
297.103479266 u |
Formula |
C14H19NO4S |
InChI |
InChI=1S/C14H19NO4S/c1-5-6-20-14-9-12(18-3)11(8-13(14)19-4)7-10(2)15(16)17/h7-9H,5-6H2,1-4H3/b10-7- |
InChIKey |
PECQYXVWIQMWQG-YFHOEESVSA-N |
Ionization Type |
Electron Ionization (EI) |
Molecular Weight |
297.369 g/mol |
Nominal Mass |
297 u |
Quality |
970 |
Retention Index |
2375 |
SMILES |
C=1(C(=CC(=C(C1)OC)SCCC)OC)\C=C\([N+](=O)[O-])C |
SPLASH |
splash10-0007-8940000000-467ae1f42cb3f46b7595 |
Source of Spectrum |
DigiLab GmbH (C) 2024 |
Synonyms |
1,4-dimethoxy-2-((1Z)-2-nitroprop-1-en-1-yl)-5-(propylsulfanyl)benzene |
Technique |
GC/MS |
Wiley ID |
DD2024_008483 |