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2,3-bis(trifluoromethylthio)bicyclo[2.2.1]hepta-2,5-diene
SpectraBase Compound ID 3csCAkzV5jc
InChI InChI=1S/C9H6F6S2/c10-8(11,12)16-6-4-1-2-5(3-4)7(6)17-9(13,14)15/h1-2,4-5H,3H2/t4-,5+
InChIKey SYPUPQCKZMIACP-SYDPRGILSA-N
Mol Weight 292.26 g/mol
Molecular Formula C9H6F6S2
Exact Mass 291.981512 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3kUmgK72cTC
Name 2,3-bis(trifluoromethylthio)bicyclo[2.2.1]hepta-2,5-diene
CAS Registry Number 114861-67-5
Comments Less than 3 mono-isotopic peaks
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Formula C9H6F6S2
InChI InChI=1S/C9H6F6S2/c10-8(11,12)16-6-4-1-2-5(3-4)7(6)17-9(13,14)15/h1-2,4-5H,3H2/t4-,5+
InChIKey SYPUPQCKZMIACP-SYDPRGILSA-N
Molecular Weight 292.257 g/mol
SMILES C1(=C([C@@]2(C[C@]1(C=C2)[H])[H])SC(F)(F)F)SC(F)(F)F
SPLASH splash10-014i-9020000000-9397b19dcb6d6ebef332
Source of Spectrum K-121-1837-4
Synonyms 2,3-bis[(trifluoromethyl)sulfanyl]bicyclo[2.2.1]hepta-2,5-diene
Wiley ID 1294872