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N-(Pent-4-en-1-yl)-N-phenyl-2-(phenylsulfinyl)aniline
SpectraBase Compound ID HWRYT4VHJl3
InChI InChI=1S/C23H23NOS/c1-2-3-12-19-24(20-13-6-4-7-14-20)22-17-10-11-18-23(22)26(25)21-15-8-5-9-16-21/h2,4-11,13-18H,1,3,12,19H2
InChIKey TVSISYMWNZAWMS-UHFFFAOYSA-N
Mol Weight 361.5 g/mol
Molecular Formula C23H23NOS
Exact Mass 361.150036 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BDO6wLyVwC2
Name N-(Pent-4-en-1-yl)-N-phenyl-2-(phenylsulfinyl)aniline
Appearance Colorless oil
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Exact Mass 361.150035538 u
Formula C23H23NOS
InChI InChI=1S/C23H23NOS/c1-2-3-12-19-24(20-13-6-4-7-14-20)22-17-10-11-18-23(22)26(25)21-15-8-5-9-16-21/h2,4-11,13-18H,1,3,12,19H2
InChIKey TVSISYMWNZAWMS-UHFFFAOYSA-N
Instrument Name Finnigan SSQ Finnigan 7000
Ionization Type EI
Literature Reference DOI 10.1021/acs.joc.3c00012
Molecular Weight 361.503 g/mol
Reported Formula C23H23ONS
SMILES C1=CC(=C(C=C1)S(=O)C1=CC=CC=C1)N(C1=CC=CC=C1)CCCC=C
SPLASH splash10-0006-0009000000-5236899aa345bb64c623
Source of Spectrum JOC-88-SM14-3ma (DOI: 10.1021/acs.joc.3c00012)
Wiley ID 1912696