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1-(Benzothiazol-2-yl)-2-isopropyl-3-methylisothiourea
SpectraBase Compound ID 62qW2prh0RI
InChI InChI=1S/C12H15N3S2/c1-8(2)16-11(13-3)15-12-14-9-6-4-5-7-10(9)17-12/h4-8H,1-3H3,(H,13,14,15)
InChIKey ZDXRTQQJALVFMG-UHFFFAOYSA-N
Mol Weight 265.39 g/mol
Molecular Formula C12H15N3S2
Exact Mass 265.07074 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID F2HOQ0Vvc2
Name 1-(Benzothiazol-2-yl)-2-isopropyl-3-methylisothiourea
Alternate Name(s) isopropyl N'-(1,3-benzothiazol-2-yl)-N-methylimidothiocarbamate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H15N3S2
InChI InChI=1S/C12H15N3S2/c1-8(2)16-11(13-3)15-12-14-9-6-4-5-7-10(9)17-12/h4-8H,1-3H3,(H,13,14,15)
InChIKey ZDXRTQQJALVFMG-UHFFFAOYSA-N
Molecular Weight 265.393 g/mol
SMILES N(\C(=N/c1sc2c(n1)cccc2)SC(C)C)C
SPLASH splash10-00or-0960000000-dffb6195ae1e5c48380d
Source of Spectrum K1-2004-4212-13
Wiley ID 1561593