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2,2',2"-(1,3,5-Benzenetriyl)tris[5-(2-hydroxyethylimino)-4,5-dihydro-4-methyl-1,3,4-thiazole]

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2,2',2"-(1,3,5-Benzenetriyl)tris[5-(2-hydroxyethylimino)-4,5-dihydro-4-methyl-1,3,4-thiazole]
SpectraBase Compound ID 23INQRSGx4v
InChI InChI=1S/C21H27N9O3S3/c1-28-19(22-4-7-31)34-16(25-28)13-10-14(17-26-29(2)20(35-17)23-5-8-32)12-15(11-13)18-27-30(3)21(36-18)24-6-9-33/h10-12,31-33H,4-9H2,1-3H3/b22-19-,23-20-,24-21+
InChIKey SITFXEHSKALGHI-JPNNFRRASA-N
Mol Weight 549.69 g/mol
Molecular Formula C21H27N9O3S3
Exact Mass 549.139899 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1HoNYlh0dnD
Name 2,2',2"-(1,3,5-Benzenetriyl)tris[5-(2-hydroxyethylimino)-4,5-dihydro-4-methyl-1,3,4-thiazole]
Alternate Name(s) 2,2',2''-(1,3,5-Benzenetriyl)tris[5-(2-hydroxyethylimino)-4,5-dihydro-4-methyl-1,3,4-thiazole]
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H27N9O3S3
InChI InChI=1S/C21H27N9O3S3/c1-28-19(22-4-7-31)34-16(25-28)13-10-14(17-26-29(2)20(35-17)23-5-8-32)12-15(11-13)18-27-30(3)21(36-18)24-6-9-33/h10-12,31-33H,4-9H2,1-3H3/b22-19-,23-20-,24-21+
InChIKey SITFXEHSKALGHI-JPNNFRRASA-N
Molecular Weight 549.687 g/mol
SMILES OCC\N=C\1SC(c2cc(C=3S\C(=N/CCO)N(N3)C)cc(c2)C=2S\C(=N/CCO)N(N2)C)=NN1C
SPLASH splash10-03dl-0272090000-5768c5ce207bf6a8b41c
Source of Spectrum H1-36-1275-10
Wiley ID 755362