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1-(5-phenyl-1,2-thiazol-3-yl)-2-[(5-phenyl-1,2-thiazol-3-yl)methyl]pentan-2-ol
SpectraBase Compound ID DhuD4Cjss9s
InChI InChI=1S/C24H24N2OS2/c1-2-13-24(27,16-20-14-22(28-25-20)18-9-5-3-6-10-18)17-21-15-23(29-26-21)19-11-7-4-8-12-19/h3-12,14-15,27H,2,13,16-17H2,1H3
InChIKey BTPKUXXRUDUMOM-UHFFFAOYSA-N
Mol Weight 420.59 g/mol
Molecular Formula C24H24N2OS2
Exact Mass 420.133006 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8I3ye8FQ5AG
Name 1-(5-phenyl-1,2-thiazol-3-yl)-2-[(5-phenyl-1,2-thiazol-3-yl)methyl]pentan-2-ol
Alternate Name(s) 1-(5-phenyl-3-isothiazolyl)-2-[(5-phenyl-3-isothiazolyl)methyl]-2-pentanol 1-(5-phenylisothiazol-3-yl)-2-[(5-phenylisothiazol-3-yl)methyl]pentan-2-ol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H24N2OS2
InChI InChI=1S/C24H24N2OS2/c1-2-13-24(27,16-20-14-22(28-25-20)18-9-5-3-6-10-18)17-21-15-23(29-26-21)19-11-7-4-8-12-19/h3-12,14-15,27H,2,13,16-17H2,1H3
InChIKey BTPKUXXRUDUMOM-UHFFFAOYSA-N
Molecular Weight 420.589 g/mol
SMILES OC(Cc1cc(sn1)-c1ccccc1)(Cc1nsc(c1)-c1ccccc1)CCC
SPLASH splash10-002b-0790000000-40ad147514fa6fd5d770
Source of Spectrum Y-32-541-30
Wiley ID 1377992