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5,2,9-Ethanylylidene-1-benzoxepin-11-one, 3,7-dichloro-2,5,5a,8,9,9a-hexahydro-
SpectraBase Compound ID 6j9Ar7KaeQo
InChI InChI=1S/C12H10Cl2O2/c13-4-1-6-5-3-8(14)12-9(10(5)15)7(2-4)11(6)16-12/h1,3,5-7,9,11-12H,2H2/t5-,6-,7+,9+,11+,12-/m0/s1
InChIKey FBQXDRBFLSUFDV-DOKYJHFNSA-N
Mol Weight 257.12 g/mol
Molecular Formula C12H10Cl2O2
Exact Mass 256.005785 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3j0lLAbi3OY
Name 5,2,9-Ethanylylidene-1-benzoxepin-11-one, 3,7-dichloro-2,5,5a,8,9,9a-hexahydro-
Alternate Name(s) 6,12-Dichloro-10-oxatetracyclo[6.5.0.0(3,11).0(4,9)]trideca-6,12-dien-2-one
CAS Registry Number 83098-65-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H10Cl2O2
InChI InChI=1S/C12H10Cl2O2/c13-4-1-6-5-3-8(14)12-9(10(5)15)7(2-4)11(6)16-12/h1,3,5-7,9,11-12H,2H2/t5-,6-,7+,9+,11+,12-/m0/s1
InChIKey FBQXDRBFLSUFDV-DOKYJHFNSA-N
Molecular Weight 257.116 g/mol
SMILES [C@]12(C([C@@]3([C@]4([C@]([C@@]2(CC(=C4)Cl)[H])(O[C@]1(C(=C3)Cl)[H])[H])[H])[H])=O)[H]
SPLASH splash10-0fba-9840000000-9e631d7807231b8d2a6f
Source of Spectrum H-65-1009-0
Wiley ID 1259360