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N,N-Diethyl-N-{2-[(4-methyl-5H-pyridazino[4,5-b]indol-1-yl)sulfanyl]ethyl}amine
SpectraBase Compound ID JGNx04cvXXz
InChI InChI=1S/C17H22N4S/c1-4-21(5-2)10-11-22-17-15-13-8-6-7-9-14(13)18-16(15)12(3)19-20-17/h6-9,18H,4-5,10-11H2,1-3H3
InChIKey YIKYLKKBSYWHJX-UHFFFAOYSA-N
Mol Weight 314.45 g/mol
Molecular Formula C17H22N4S
Exact Mass 314.156518 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 31wufmXktU
Name N,N-Diethyl-N-{2-[(4-methyl-5H-pyridazino[4,5-b]indol-1-yl)sulfanyl]ethyl}amine
Appearance Brownish-yellow crystals
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Exact Mass 314.156517898 u
Formula C17H22N4S
InChI InChI=1S/C17H22N4S/c1-4-21(5-2)10-11-22-17-15-13-8-6-7-9-14(13)18-16(15)12(3)19-20-17/h6-9,18H,4-5,10-11H2,1-3H3
InChIKey YIKYLKKBSYWHJX-UHFFFAOYSA-N
Instrument Name Shimadzu QP 5050A DI 50
Ionization Type EI
Literature Reference DOI 10.3998/ark.5550190.0004.e19
Quality 119
SMILES N1C2=C(C3=C(N=NC(=C13)C)SCCN(CC)CC)C=CC=C2
SPLASH splash10-0072-9000000000-533b9cc90919b573f521
Source of Spectrum ARK-2003-207-17 (DOI: 10.3998/ark.5550190.0004.e19)
Wiley ID 1899824