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1,3,5-triisopropyl-2-isothiocyanato-benzene
SpectraBase Compound ID 4jZBFKNsICL
InChI InChI=1S/C16H23NS/c1-10(2)13-7-14(11(3)4)16(17-9-18)15(8-13)12(5)6/h7-8,10-12H,1-6H3
InChIKey WJONPMWMICRVDE-UHFFFAOYSA-N
Mol Weight 261.43 g/mol
Molecular Formula C16H23NS
Exact Mass 261.155121 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LX2N0VD9GXA
Name 1,3,5-triisopropyl-2-isothiocyanato-benzene
Alternate Name(s) 2-isothiocyanato-1,3,5-tri(propan-2-yl)benzene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H23NS
InChI InChI=1S/C16H23NS/c1-10(2)13-7-14(11(3)4)16(17-9-18)15(8-13)12(5)6/h7-8,10-12H,1-6H3
InChIKey WJONPMWMICRVDE-UHFFFAOYSA-N
Molecular Weight 261.427 g/mol
SMILES c1(c(cc(cc1C(C)C)C(C)C)C(C)C)N=C=S
SPLASH splash10-01ot-0090000000-ddc0db3210c4e779d265
Source of Spectrum SO-0-826-5
Wiley ID 1538273