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3-(1,3-benzothiazol-2-yl)-1,1,1-trifluoro-2-propanone
SpectraBase Compound ID 9Odc0Mvp8Ss
InChI InChI=1S/C10H6F3NOS/c11-10(12,13)8(15)5-9-14-6-3-1-2-4-7(6)16-9/h1-4H,5H2
InChIKey NLHUDQAMKLHHSW-UHFFFAOYSA-N
Mol Weight 245.22 g/mol
Molecular Formula C10H6F3NOS
Exact Mass 245.012219 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1qrIOOWq2Kg
Name 3-(1,3-benzothiazol-2-yl)-1,1,1-trifluoro-2-propanone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H6F3NOS
InChI InChI=1S/C10H6F3NOS/c11-10(12,13)8(15)5-9-14-6-3-1-2-4-7(6)16-9/h1-4H,5H2
InChIKey NLHUDQAMKLHHSW-UHFFFAOYSA-N
Molecular Weight 245.219 g/mol
SMILES c1(nc2ccccc2s1)CC(C(F)(F)F)=O
SPLASH splash10-002b-0910000000-4a54ce7b2994aa2a72a3
Source of Spectrum F-53-5854-17
Synonyms 3-(1,3-benzothiazol-2-yl)-1,1,1-trifluoro-acetone 3-(1,3-benzothiazol-2-yl)-1,1,1-trifluoro-propan-2-one 3-(1,3-benzothiazol-2-yl)-1,1,1-tris(fluoranyl)propan-2-one
Wiley ID 801766