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3-[2-(2-{[2-(2-Hydroxyethoxy)ethyl]sulfanyl}ethoxy)ethoxy]-4-(methylamino)benzaldehyde
SpectraBase Compound ID DeqMB5qti22
InChI InChI=1S/C16H25NO5S/c1-17-15-3-2-14(13-19)12-16(15)22-7-6-21-9-11-23-10-8-20-5-4-18/h2-3,12-13,17-18H,4-11H2,1H3
InChIKey AHWVITNQZCWLAB-UHFFFAOYSA-N
Mol Weight 343.44 g/mol
Molecular Formula C16H25NO5S
Exact Mass 343.145344 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CutRL4DqEWX
Name 3-[2-(2-{[2-(2-Hydroxyethoxy)ethyl]sulfanyl}ethoxy)ethoxy]-4-(methylamino)benzaldehyde
Appearance Yellow oil
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Formula C16H25NO5S
InChI InChI=1S/C16H25NO5S/c1-17-15-3-2-14(13-19)12-16(15)22-7-6-21-9-11-23-10-8-20-5-4-18/h2-3,12-13,17-18H,4-11H2,1H3
InChIKey AHWVITNQZCWLAB-UHFFFAOYSA-N
Instrument Name Varian MAT-311A or Finnigan MAT 8430
Ionization Type EI
Literature Reference DOI 10.3998/ark.5550190.0005.b06
Molecular Weight 343.438 g/mol
Reported Formula C16H25NO5S
SMILES OCCOCCSCCOCCOc1cc(ccc1NC)C=O
SPLASH splash10-0f6y-2902000000-36438aadb86d9466f099
Source of Spectrum ARK-2004-41-5e
Thin-Layer Chromatography Rf = 0.41 (C6H6/EtOAc, 5:1)
Wiley ID 1875857