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Chloralose-M/artifact 5HFB
SpectraBase Compound ID Fzyo3ZHJXcQ
InChI InChI=1S/C26H7F35O11/c27-12(28,17(37,38)22(47,48)49)7(62)67-1-2(68-8(63)13(29,30)18(39,40)23(50,51)52)3-4(70-9(64)14(31,32)19(41,42)24(53,54)55)5(71-10(65)15(33,34)20(43,44)25(56,57)58)6(69-3)72-11(66)16(35,36)21(45,46)26(59,60)61/h2-6H,1H2
InChIKey BHNPBEWXVMTILX-UHFFFAOYSA-N
Mol Weight 1160.28 g/mol
Molecular Formula C26H7F35O11
Exact Mass 1159.942947 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CC09RfqHXv2
Name Chloralose-M/artifact 5HFB
Classification Hypnotic Rodenticide
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Exact Mass 1159.942946739 u
Formula C26H7F35O11
InChI InChI=1S/C26H7F35O11/c27-12(28,17(37,38)22(47,48)49)7(62)67-1-2(68-8(63)13(29,30)18(39,40)23(50,51)52)3-4(70-9(64)14(31,32)19(41,42)24(53,54)55)5(71-10(65)15(33,34)20(43,44)25(56,57)58)6(69-3)72-11(66)16(35,36)21(45,46)26(59,60)61/h2-6H,1H2
InChIKey BHNPBEWXVMTILX-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 1160.275 g/mol
SMILES C(C(OC1C(OC(=O)C(C(C(F)(F)F)(F)F)(F)F)C(C(OC(=O)C(F)(F)C(C(F)(F)F)(F)F)COC(=O)C(F)(F)C(C(F)(F)F)(F)F)OC1OC(=O)C(F)(C(C(F)(F)F)(F)F)F)=O)(F)(C(C(F)(F)F)(F)F)F
SPLASH splash10-01b9-9520000000-40f8dcfe2a4abb45809b
Sample Comments The MMPW Reference Handbook and associated Tables are attached to Record #1, under the Attachments tab. Refer to these references for an explanation of the Sample Preparation Procedure "Detected" abbreviations, as well as other relevant information pertaining to this database.
Source of Spectrum H.H.Maurer, M.Meyer, K.Pfleger, A.A. Weber / University of Saarland, D-66424 Homburg Germany
Synonyms Chloralose-M/artifact (detrichloroethylidenyl-) 5HFB
Technique GC/MS
Wiley ID MMPW6e_5895