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(4Z)-4-[(2,6-Dimethylphenyl)imino]-1-(2-hydroxy-5-nitrophenyl)-1,3-diazaspiro[4.4]nonane-2-thione
SpectraBase Compound ID CSqQ0rw0hxa
InChI InChI=1S/C21H22N4O3S/c1-13-6-5-7-14(2)18(13)22-19-21(10-3-4-11-21)24(20(29)23-19)16-12-15(25(27)28)8-9-17(16)26/h5-9,12,26H,3-4,10-11H2,1-2H3,(H,22,23,29)
InChIKey ACOYROITUBWINW-UHFFFAOYSA-N
Mol Weight 410.49 g/mol
Molecular Formula C21H22N4O3S
Exact Mass 410.141262 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4ErgJr6mnxu
Name (4Z)-4-[(2,6-Dimethylphenyl)imino]-1-(2-hydroxy-5-nitrophenyl)-1,3-diazaspiro[4.4]nonane-2-thione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H22N4O3S
InChI InChI=1S/C21H22N4O3S/c1-13-6-5-7-14(2)18(13)22-19-21(10-3-4-11-21)24(20(29)23-19)16-12-15(25(27)28)8-9-17(16)26/h5-9,12,26H,3-4,10-11H2,1-2H3,(H,22,23,29)
InChIKey ACOYROITUBWINW-UHFFFAOYSA-N
Molecular Weight 410.492 g/mol
SMILES N1C(N(c2c(ccc(c2)N(=O)=O)O)C2(\C1=N/c1c(cccc1C)C)CCCC2)=S
SPLASH splash10-0fb9-9500000000-026bc93bf314aac66023
Synonyms 1-(2-Hydroxy-5-nitrophenyl)-4-(2,6-xylylimino)-1,3-diazaspiro[4.4]nonane-2-thione 4-(2,6-dimethylanilino)-1-(2-hydroxy-5-nitrophenyl)-1,3-diazaspiro[4.4]non-3-ene-2-thione 4-[(2,6-dimethylphenyl)amino]-1-(5-nitro-2-oxidanyl-phenyl)-1,3-diazaspiro[4.4]non-3-ene-2-thione
Wiley ID 1469073