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N-(4-Methylbenzenesulfonyl)-2-(1-oxononyl)-3-phenylaziridine
SpectraBase Compound ID AezAL659wVa
InChI InChI=1S/C24H31NO3S/c1-3-4-5-6-7-11-14-22(26)24-23(20-12-9-8-10-13-20)25(24)29(27,28)21-17-15-19(2)16-18-21/h8-10,12-13,15-18,23-24H,3-7,11,14H2,1-2H3
InChIKey GMJKSAUDZLCARM-UHFFFAOYSA-N
Mol Weight 413.58 g/mol
Molecular Formula C24H31NO3S
Exact Mass 413.202465 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID J0Xavoof5TG
Name N-(4-Methylbenzenesulfonyl)-2-(1-oxononyl)-3-phenylaziridine
Alternate Name(s) 1-{1-[(4-methylphenyl)sulfonyl]-3-phenyl-2-aziridinyl}-1-nonanone
Comments Less than 3 mono-isotopic peaks
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Formula C24H31NO3S
InChI InChI=1S/C24H31NO3S/c1-3-4-5-6-7-11-14-22(26)24-23(20-12-9-8-10-13-20)25(24)29(27,28)21-17-15-19(2)16-18-21/h8-10,12-13,15-18,23-24H,3-7,11,14H2,1-2H3
InChIKey GMJKSAUDZLCARM-UHFFFAOYSA-N
Molecular Weight 413.576 g/mol
SMILES C1(N(C1c1ccccc1)S(=O)(=O)c1ccc(cc1)C)C(CCCCCCCC)=O
SPLASH splash10-0a4i-0090000000-8dd8f0eb50f41e4c6e12
Source of Spectrum J-64-3188-4
Wiley ID 1530005