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Butylphosphonic acid, heptyl 2-isopropoxyphenyl ester
SpectraBase Compound ID 1LAVnswZsP9
InChI InChI=1S/C20H35O4P/c1-5-7-9-10-13-16-22-25(21,17-8-6-2)24-20-15-12-11-14-19(20)23-18(3)4/h11-12,14-15,18H,5-10,13,16-17H2,1-4H3
InChIKey XDQQWXPUWNPCIX-UHFFFAOYSA-N
Mol Weight 370.5 g/mol
Molecular Formula C20H35O4P
Exact Mass 370.227297 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JE1WeuGoM4j
Name Butylphosphonic acid, heptyl 2-isopropoxyphenyl ester
Alternate Name(s) 1-[butyl(heptoxy)phosphoryl]oxy-2-propan-2-yloxybenzene 1-[butyl(heptoxy)phosphoryl]oxy-2-propan-2-yloxy-benzene
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Formula C20H35O4P
InChI InChI=1S/C20H35O4P/c1-5-7-9-10-13-16-22-25(21,17-8-6-2)24-20-15-12-11-14-19(20)23-18(3)4/h11-12,14-15,18H,5-10,13,16-17H2,1-4H3
InChIKey XDQQWXPUWNPCIX-UHFFFAOYSA-N
Molecular Weight 370.470 g/mol
SMILES CCCCCCCOP(Oc1ccccc1OC(C)C)(CCCC)=O
SPLASH splash10-001i-3592000000-3e9a872899b4ff1c190f
Source of Spectrum NP-13-5346-0
Wiley ID 1111112