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syn-9-fluoro-2,11-dithia[3.3]metacyclophane
SpectraBase Compound ID LQrBqzn9nPm
InChI InChI=1S/C16H15FS2/c17-16-11-19-15-6-2-4-13(8-15)10-18-9-12-3-1-5-14(16)7-12/h1-8,16H,9-11H2
InChIKey YJKYSHZEUVOWJD-UHFFFAOYSA-N
Mol Weight 290.41 g/mol
Molecular Formula C16H15FS2
Exact Mass 290.059921 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3lRIBnA9Szg
Name syn-9-fluoro-2,11-dithia[3.3]metacyclophane
CAS Registry Number 123050-35-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H15FS2
InChI InChI=1S/C16H15FS2/c17-16-11-19-15-6-2-4-13(8-15)10-18-9-12-3-1-5-14(16)7-12/h1-8,16H,9-11H2
InChIKey YJKYSHZEUVOWJD-UHFFFAOYSA-N
Molecular Weight 290.414 g/mol
SMILES C1Sc2cc(CSCc3cc(C1F)ccc3)ccc2
SPLASH splash10-0006-0910000000-4f1ca445fe2aa8251fe6
Source of Spectrum J-54-5878-4
Synonyms 4-Fluoro-2,11-dithiatricyclo[11.3.1.1(5,9)]octadeca-1(17),5(18),6,8,13,15-hexaene
Wiley ID 1293514