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N-{(1E)-[2,5-bis-(butylthio)-3,4-dihydro-2H-pyran-2-yl]methylen}butylamine
SpectraBase Compound ID IIPKqqojmXi
InChI InChI=1S/C18H33NOS2/c1-4-7-12-19-16-18(22-14-9-6-3)11-10-17(15-20-18)21-13-8-5-2/h15-16H,4-14H2,1-3H3/b19-16+
InChIKey KGYNTJHCXJXQTP-KNTRCKAVSA-N
Mol Weight 343.6 g/mol
Molecular Formula C18H33NOS2
Exact Mass 343.200357 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Ayk40NFiYem
Name N-{(1E)-[2,5-bis-(butylthio)-3,4-dihydro-2H-pyran-2-yl]methylen}butylamine
Appearance Dark brown oil
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Formula C18H33NOS2
InChI InChI=1S/C18H33NOS2/c1-4-7-12-19-16-18(22-14-9-6-3)11-10-17(15-20-18)21-13-8-5-2/h15-16H,4-14H2,1-3H3/b19-16+
InChIKey KGYNTJHCXJXQTP-KNTRCKAVSA-N
Instrument Name Shimadzu GCMS QP 5050A
Ionization Type EI
Literature Reference DOI 10.24820/ark.5550190.p011.567
Molecular Weight 343.588 g/mol
SMILES C1(SCCCC)(\C=N\CCCC)OC=C(CC1)SCCCC
SPLASH splash10-000x-9000000000-2bd1981edc7bb001cbcb
Source of Spectrum ARK-2021-335-3a
Wiley ID 1873149