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2-chloro-1,3-bis(methoxymethoxy)-5-(tridec-6-yn-1-yl)benzene
SpectraBase Compound ID DBR00oJxPhq
InChI InChI=1S/C23H35ClO4/c1-4-5-6-7-8-9-10-11-12-13-14-15-20-16-21(27-18-25-2)23(24)22(17-20)28-19-26-3/h16-17H,4-8,11-15,18-19H2,1-3H3
InChIKey TXQVFRADEIOIKS-UHFFFAOYSA-N
Mol Weight 411.0 g/mol
Molecular Formula C23H35ClO4
Exact Mass 410.222387 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EXjgbHbbwsM
Name 2-chloro-1,3-bis(methoxymethoxy)-5-(tridec-6-yn-1-yl)benzene
Appearance Colorless oil
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Formula C23H35ClO4
InChI InChI=1S/C23H35ClO4/c1-4-5-6-7-8-9-10-11-12-13-14-15-20-16-21(27-18-25-2)23(24)22(17-20)28-19-26-3/h16-17H,4-8,11-15,18-19H2,1-3H3
InChIKey TXQVFRADEIOIKS-UHFFFAOYSA-N
Instrument Name JEOL JMS-700 / JMS-DX303
Ionization Type EI
Literature Reference DOI 10.1021/acs.jnatprod.7b00456
Molecular Weight 410.982 g/mol
Reported Formula C23H35O4(35)Cl
SMILES c1(cc(cc(c1Cl)OCOC)CCCCCC#CCCCCCC)OCOC
SPLASH splash10-0002-9003200000-a5c73d0b3c18399aa00e
Source of Spectrum G4-80-SM13-18d
Wiley ID 1867577