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Thiourea, N-(1,1-dimethylethyl)-N'-4-isoxazolyl-
SpectraBase Compound ID 1rWXJnKBPYC
InChI InChI=1S/C8H13N3OS/c1-8(2,3)11-7(13)10-6-4-9-12-5-6/h4-5H,1-3H3,(H2,10,11,13)
InChIKey ODNUOORSWZTVMV-UHFFFAOYSA-N
Mol Weight 199.27 g/mol
Molecular Formula C8H13N3OS
Exact Mass 199.077933 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 39NXuWVb94D
Name Thiourea, N-(1,1-dimethylethyl)-N'-4-isoxazolyl-
CAS Registry Number 122686-05-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H13N3OS
InChI InChI=1S/C8H13N3OS/c1-8(2,3)11-7(13)10-6-4-9-12-5-6/h4-5H,1-3H3,(H2,10,11,13)
InChIKey ODNUOORSWZTVMV-UHFFFAOYSA-N
Molecular Weight 199.272 g/mol
SMILES N(c1conc1)C(NC(C)(C)C)=S
SPLASH splash10-0a4i-9100000000-79f43ca2c0b1b4e396f9
Source of Spectrum H-72-564-3
Synonyms N-(t-butyl)-N'-(isoxazol-4-l)thiourea N-(tert-butyl)-N'-(4-isoxazolyl)thiourea
Wiley ID 1196506