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FOANIXZHAMJWOI-UHFFFAOYSA-N
SpectraBase Compound ID HOs5JcjAjGg
InChI InChI=1S/C17H16Br2O3/c1-11(2)22-16(20)17(21,12-3-7-14(18)8-4-12)13-5-9-15(19)10-6-13/h3-11,21H,1-2H3
InChIKey FOANIXZHAMJWOI-UHFFFAOYSA-N
Mol Weight 428.12 g/mol
Molecular Formula C17H16Br2O3
Exact Mass 425.94662 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B3O3J7Hvqr
Name Bromopropylate
CAS Registry Number 18181-80-1
Classification Acaricide
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Exact Mass 425.946620372 u
Formula C17H16Br2O3
InChI InChI=1S/C17H16Br2O3/c1-11(2)22-16(20)17(21,12-3-7-14(18)8-4-12)13-5-9-15(19)10-6-13/h3-11,21H,1-2H3
InChIKey FOANIXZHAMJWOI-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 428.120 g/mol
SMILES C(C(c1ccc(Br)cc1)(c1ccc(cc1)Br)O)(OC(C)C)=O
SPLASH splash10-000f-3907000000-e6bed458edf626930960
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
Technique GC/MS
Wiley ID MMPW6e_4142