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Thiourea, N-(5-methyl-4-isoxazolyl)-N'-propyl-
SpectraBase Compound ID 9ciyEV9K7H
InChI InChI=1S/C8H13N3OS/c1-3-4-9-8(13)11-7-5-10-12-6(7)2/h5H,3-4H2,1-2H3,(H2,9,11,13)
InChIKey MHDMMNHKBNVBRT-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 GhZeyU8Skfk
Name Thiourea, N-(5-methyl-4-isoxazolyl)-N'-propyl-
Alternate Name(s) N-(5-methyl-4-isoxazolyl)-N'-propylthiourea N-(5-methylisoxazol-4-yl)-N'-propylthiourea
CAS Registry Number 122686-07-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H13N3OS
InChI InChI=1S/C8H13N3OS/c1-3-4-9-8(13)11-7-5-10-12-6(7)2/h5H,3-4H2,1-2H3,(H2,9,11,13)
InChIKey MHDMMNHKBNVBRT-UHFFFAOYSA-N
Molecular Weight 199.272 g/mol
SMILES N(c1c(onc1)C)C(=S)NCCC
SPLASH splash10-0007-9400000000-a545da3d343f9fd550d5
Source of Spectrum H-72-563-3
Wiley ID 1196504