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5,5-dioxo-4-oxa-5.lambda.6-thiatricyclo [4.2.1.0(3,7)]nonan-2-yl-chloroacetate
SpectraBase Compound ID LNJygGtW9ny
InChI InChI=1S/C9H11ClO5S/c10-3-7(11)14-8-4-1-5-6(2-4)16(12,13)15-9(5)8/h4-6,8-9H,1-3H2/t4-,5+,6-,8-,9-/m0/s1
InChIKey CSGOTFHPTFAEEJ-NEKFFXKBSA-N
Mol Weight 266.69 g/mol
Molecular Formula C9H11ClO5S
Exact Mass 266.001572 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4uT9M7cB5sn
Name 5,5-dioxo-4-oxa-5.lambda.6-thiatricyclo [4.2.1.0(3,7)]nonan-2-yl-chloroacetate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H11ClO5S
InChI InChI=1S/C9H11ClO5S/c10-3-7(11)14-8-4-1-5-6(2-4)16(12,13)15-9(5)8/h4-6,8-9H,1-3H2/t4-,5+,6-,8-,9-/m0/s1
InChIKey CSGOTFHPTFAEEJ-NEKFFXKBSA-N
Instrument Name Agilent 7890A GC
Ionization Type EI
SMILES [C@@]12([C@]([C@]3(C[C@@]2([C@](C3)(S(O1)(=O)=O)[H])[H])[H])(OC(CCl)=O)[H])[H]
SPLASH splash10-00di-0900000000-12581b01d5a26a20055c
Source of Spectrum JP6079360B2
Wiley ID 1855305