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(E)-1-(4-Propylthio-2,5-dimethoxyphenyl)-2-nitroethene
SpectraBase Compound ID Eow80ttmoBx
InChI InChI=1S/C13H17NO4S/c1-4-7-19-13-9-11(17-2)10(5-6-14(15)16)8-12(13)18-3/h5-6,8-9H,4,7H2,1-3H3/b6-5+
InChIKey WOACJZNZWFRPOA-AATRIKPKSA-N
Mol Weight 283.34 g/mol
Molecular Formula C13H17NO4S
Exact Mass 283.087829 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8FUPimkddTs
Name (E)-1-(4-Propylthio-2,5-dimethoxyphenyl)-2-nitroethene
Classification Designer drug precursor
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 283.087829201 u
Formula C13H17NO4S
InChI InChI=1S/C13H17NO4S/c1-4-7-19-13-9-11(17-2)10(5-6-14(15)16)8-12(13)18-3/h5-6,8-9H,4,7H2,1-3H3/b6-5+
InChIKey WOACJZNZWFRPOA-AATRIKPKSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 283.342 g/mol
Nominal Mass 283 u
Quality 958
Retention Index 2458
SMILES C=1(C(=CC(=C(C1)OC)SCCC)OC)\C=C\[N+](=O)[O-]
SPLASH splash10-0016-9630000000-99808a73b42bce394467
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms 1,4-dimethoxy-2-((E)-2-nitroethenyl)-5-(propylsulfanyl)benzene
Technique GC/MS
Wiley ID DD2024_008482