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14-Chloro-3,8-dithiabicyclo[8.3.1]tetradeca-1(14),10,12-trien-5-yne
SpectraBase Compound ID 1K9cxEZ6qTP
InChI InChI=1S/C12H11ClS2/c13-12-10-4-3-5-11(12)9-15-7-2-1-6-14-8-10/h3-5H,6-9H2
InChIKey JUDFMWBHQAHBHH-UHFFFAOYSA-N
Mol Weight 254.79 g/mol
Molecular Formula C12H11ClS2
Exact Mass 253.99907 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CCirW9HiXMM
Name 14-Chloro-3,8-dithiabicyclo[8.3.1]tetradeca-1(14),10,12-trien-5-yne
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H11ClS2
InChI InChI=1S/C12H11ClS2/c13-12-10-4-3-5-11(12)9-15-7-2-1-6-14-8-10/h3-5H,6-9H2
InChIKey JUDFMWBHQAHBHH-UHFFFAOYSA-N
Literature Reference DOI 10.1002/cber.19941270830
Molecular Weight 254.793 g/mol
SMILES C1#CCSCc2cccc(CSC1)c2Cl
SPLASH splash10-0uy3-2930000000-f77cfb300f37f435033f
Source of Spectrum K-127-1535-4c
Wiley ID 1792382