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Butylphosphonic acid, 4-chloro-3-methylphenyl decyl ester
SpectraBase Compound ID KqsRKHCWhJ3
InChI InChI=1S/C21H36ClO3P/c1-4-6-8-9-10-11-12-13-16-24-26(23,17-7-5-2)25-20-14-15-21(22)19(3)18-20/h14-15,18H,4-13,16-17H2,1-3H3
InChIKey YDEPFNKKJYPZDG-UHFFFAOYSA-N
Mol Weight 402.9 g/mol
Molecular Formula C21H36ClO3P
Exact Mass 402.20906 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1XTemgeMKAC
Name Butylphosphonic acid, 4-chloro-3-methylphenyl decyl ester
Alternate Name(s) 4-[butyl(decoxy)phosphoryl]oxy-1-chloro-2-methylbenzene 4-[butyl(decoxy)phosphoryl]oxy-1-chloranyl-2-methyl-benzene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H36ClO3P
InChI InChI=1S/C21H36ClO3P/c1-4-6-8-9-10-11-12-13-16-24-26(23,17-7-5-2)25-20-14-15-21(22)19(3)18-20/h14-15,18H,4-13,16-17H2,1-3H3
InChIKey YDEPFNKKJYPZDG-UHFFFAOYSA-N
Molecular Weight 402.943 g/mol
SMILES c1(c(ccc(c1)OP(CCCC)(=O)OCCCCCCCCCC)Cl)C
SPLASH splash10-03di-2390100000-49ea43198d4a85645204
Source of Spectrum NP-14-5214-0
Wiley ID 1111814