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N'-(3-chlorophenyl)-N,N-dipentylthiourea

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N'-(3-chlorophenyl)-N,N-dipentylthiourea
SpectraBase Compound ID IxStZ0zi2iv
InChI InChI=1S/C17H27ClN2S/c1-3-5-7-12-20(13-8-6-4-2)17(21)19-16-11-9-10-15(18)14-16/h9-11,14H,3-8,12-13H2,1-2H3,(H,19,21)
InChIKey UHYOVXICYJXNSC-UHFFFAOYSA-N
Mol Weight 326.93 g/mol
Molecular Formula C17H27ClN2S
Exact Mass 326.158348 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BSyGiC6BeaP
Name 1,1-Diamyl-3-(3-chlorophenyl)thiourea
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H27ClN2S
InChI InChI=1S/C17H27ClN2S/c1-3-5-7-12-20(13-8-6-4-2)17(21)19-16-11-9-10-15(18)14-16/h9-11,14H,3-8,12-13H2,1-2H3,(H,19,21)
InChIKey UHYOVXICYJXNSC-UHFFFAOYSA-N
Molecular Weight 326.930 g/mol
SMILES N(C(=S)N(CCCCC)CCCCC)c1cc(Cl)ccc1
SPLASH splash10-0f6x-9800000000-e934fb34aea453d908d3
Synonyms 3-(3-Chlorophenyl)-1,1-dipentylthiourea
Wiley ID 1450377