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1-(Dibutylamino)-3-(thiophen-3-yl)indolizine-7-carbaldehyde
SpectraBase Compound ID 5lgTu9SfaQ4
InChI InChI=1S/C21H26N2OS/c1-3-5-9-22(10-6-4-2)20-14-19(18-8-12-25-16-18)23-11-7-17(15-24)13-21(20)23/h7-8,11-16H,3-6,9-10H2,1-2H3
InChIKey PNXFQNFUCIOWPR-UHFFFAOYSA-N
Mol Weight 354.51 g/mol
Molecular Formula C21H26N2OS
Exact Mass 354.176585 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1UXQoVxjrbu
Name 1-(Dibutylamino)-3-(thiophen-3-yl)indolizine-7-carbaldehyde
Appearance Red oil
Carrier Gas Nitrogen (1 mL/min)
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Exact Mass 354.176584638 u
Formula C21H26N2OS
GC Column HP-5MS (0.25 mm, film thickness 0.25 micrometer)
GC Oven Program Oven temp 270oC
InChI InChI=1S/C21H26N2OS/c1-3-5-9-22(10-6-4-2)20-14-19(18-8-12-25-16-18)23-11-7-17(15-24)13-21(20)23/h7-8,11-16H,3-6,9-10H2,1-2H3
InChIKey PNXFQNFUCIOWPR-UHFFFAOYSA-N
Instrument Name Agilent 5763
Ionization Type EI
Literature Reference DOI 10.1002/anie.202215916
Molecular Weight 354.512 g/mol
Quality 171
Reported Formula C21H26N2OS
SMILES C(CCC)N(CCCC)C=1C=C(N2C=CC(=CC12)C=O)C1=CSC=C1
SPLASH splash10-0pb9-0195000000-275b79401d4241c61c90
Source of Spectrum ACI-62-SM25-3s (DOI: 10.1002/anie.202215916)
Thin-Layer Chromatography 0.5 (hexane/EtOAc, 8:2)
Wiley ID 1908353