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1-(2,6-dimethylphenyl)-4,4-diphenyl-2-(methylthio)-5-(isopropylimino)-2-imidazoline
SpectraBase Compound ID G7bmgxBPJFU
InChI InChI=1S/C27H29N3S/c1-19(2)28-25-27(22-15-8-6-9-16-22,23-17-10-7-11-18-23)29-26(31-5)30(25)24-20(3)13-12-14-21(24)4/h6-19H,1-5H3/b28-25-
InChIKey KWPKSUGFAGETIL-FVDSYPCUSA-N
Mol Weight 427.61 g/mol
Molecular Formula C27H29N3S
Exact Mass 427.208219 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ChIr5pfmHJA
Name 1-(2,6-dimethylphenyl)-4,4-diphenyl-2-(methylthio)-5-(isopropylimino)-2-imidazoline
CAS Registry Number 118514-94-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C27H29N3S
InChI InChI=1S/C27H29N3S/c1-19(2)28-25-27(22-15-8-6-9-16-22,23-17-10-7-11-18-23)29-26(31-5)30(25)24-20(3)13-12-14-21(24)4/h6-19H,1-5H3/b28-25-
InChIKey KWPKSUGFAGETIL-FVDSYPCUSA-N
Molecular Weight 427.610 g/mol
SMILES C1(\C(N(C(=N1)SC)c1c(cccc1C)C)=N\C(C)C)(c1ccccc1)c1ccccc1
SPLASH splash10-00di-0091200000-9959911647a1278d8743
Source of Spectrum J-54-1189-10
Synonyms N-[(4Z)-3-(2,6-dimethylphenyl)-2-(methylsulfanyl)-5,5-diphenyl-3,5-dihydro-4H-imidazol-4-ylidene]-2-propanamine N-[(4Z)-3-(2,6-dimethylphenyl)-2-(methylsulfanyl)-5,5-diphenyl-3,5-dihydro-4H-imidazol-4-ylidene]-N-[(Z)-1-methylethyl]amine
Wiley ID 1380462