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5-(3-bromopropyl)-2-chloro-1,3-bis(methoxymethoxy)benzene
SpectraBase Compound ID 68hnx8BZmQF
InChI InChI=1S/C13H18BrClO4/c1-16-8-18-11-6-10(4-3-5-14)7-12(13(11)15)19-9-17-2/h6-7H,3-5,8-9H2,1-2H3
InChIKey YFSPLDDFYOPLAI-UHFFFAOYSA-N
Mol Weight 353.64 g/mol
Molecular Formula C13H18BrClO4
Exact Mass 352.0077 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JIoAmpdQlQr
Name 5-(3-bromopropyl)-2-chloro-1,3-bis(methoxymethoxy)benzene
Appearance Colorless oil
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Formula C13H18BrClO4
InChI InChI=1S/C13H18BrClO4/c1-16-8-18-11-6-10(4-3-5-14)7-12(13(11)15)19-9-17-2/h6-7H,3-5,8-9H2,1-2H3
InChIKey YFSPLDDFYOPLAI-UHFFFAOYSA-N
Instrument Name JEOL JMS-700 / JMS-DX303
Ionization Type EI
Literature Reference DOI 10.1021/acs.jnatprod.7b00456
Molecular Weight 353.640 g/mol
Reported Formula C13H18O4(79)Br(35)Cl
SMILES c1(cc(cc(c1Cl)OCOC)CCCBr)OCOC
SPLASH splash10-0002-9003000000-cec122fc6d606c495349
Source of Spectrum G4-80-SM12-17h
Wiley ID 1867576