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1,3,5-TRIMETHYL-4-THIOCYANATOBENZENE
SpectraBase Compound ID 61LVixELOTG
InChI InChI=1S/C10H11NS/c1-7-4-8(2)10(12-6-11)9(3)5-7/h4-5H,1-3H3
InChIKey JWUVOBXFPXHNDZ-UHFFFAOYSA-N
Mol Weight 177.26 g/mol
Molecular Formula C10H11NS
Exact Mass 177.061221 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HEyW8KQ0Y8M
Name 1,3,5-Trimethyl-2-thiocyanatobenzene
Appearance Yellow powder
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H11NS
InChI InChI=1S/C10H11NS/c1-7-4-8(2)10(12-6-11)9(3)5-7/h4-5H,1-3H3
InChIKey JWUVOBXFPXHNDZ-UHFFFAOYSA-N
Ionization Type EI
Literature Reference DOI 10.1002/chem.201806261
Molecular Weight 177.265 g/mol
Reported Formula C10H11NS
SMILES Cc1cc(c(c(c1)C)SC#N)C
SPLASH splash10-002f-4900000000-5b0f8e8cc3ec0e82537a
Source of Spectrum QE-25-SM42-7b
Wiley ID 1848475