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N-Benzyl-N'-[5-(4(5)-imidazolyl)pentyl]thiourea oxalate
SpectraBase Compound ID 2zoYqyuk8JB
InChI InChI=1S/C16H22N4S/c1-13(15-11-17-12-20-15)6-5-9-18-16(21)19-10-14-7-3-2-4-8-14/h2-4,7-8,11-13H,5-6,9-10H2,1H3,(H,17,20)(H2,18,19,21)
InChIKey HXXQYAJAUZMUFT-UHFFFAOYSA-N
Mol Weight 302.44 g/mol
Molecular Formula C16H22N4S
Exact Mass 302.156518 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LxDmbEb62mr
Name N-Benzyl-N'-[5-(4(5)-imidazolyl)pentyl]thiourea oxalate
Alternate Name(s) N-benzyl-N'-[4-(1H-imidazol-5-yl)pentyl]thiourea
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H22N4S
InChI InChI=1S/C16H22N4S/c1-13(15-11-17-12-20-15)6-5-9-18-16(21)19-10-14-7-3-2-4-8-14/h2-4,7-8,11-13H,5-6,9-10H2,1H3,(H,17,20)(H2,18,19,21)
InChIKey HXXQYAJAUZMUFT-UHFFFAOYSA-N
Molecular Weight 302.440 g/mol
SMILES N(C(=S)NCCCC(c1[nH]cnc1)C)Cc1ccccc1
SPLASH splash10-000y-9301000000-1e9cb6dd2dd5062e8f2f
Source of Spectrum E1-38-2249-5
Wiley ID 1598413