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5-Chlorovaleric acid, 4-benzyloxyphenyl ester
SpectraBase Compound ID DfDPZy3Ijyy
InChI InChI=1S/C18H19ClO3/c19-13-5-4-8-18(20)22-17-11-9-16(10-12-17)21-14-15-6-2-1-3-7-15/h1-3,6-7,9-12H,4-5,8,13-14H2
InChIKey WXPUTBOXHOZGMQ-UHFFFAOYSA-N
Mol Weight 318.8 g/mol
Molecular Formula C18H19ClO3
Exact Mass 318.102272 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AsMcpLP8Ejn
Name 5-Chlorovaleric acid, 4-benzyloxyphenyl ester
Alternate Name(s) 5-Chloropentanoic acid (4-phenylmethoxyphenyl) ester (4-phenylmethoxyphenyl) 5-chloropentanoate (4-benzyloxyphenyl) 5-chloropentanoate (4-phenylmethoxyphenyl) 5-chloranylpentanoate
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Formula C18H19ClO3
InChI InChI=1S/C18H19ClO3/c19-13-5-4-8-18(20)22-17-11-9-16(10-12-17)21-14-15-6-2-1-3-7-15/h1-3,6-7,9-12H,4-5,8,13-14H2
InChIKey WXPUTBOXHOZGMQ-UHFFFAOYSA-N
Molecular Weight 318.800 g/mol
SMILES c1ccc(cc1)COc1ccc(OC(CCCCCl)=O)cc1
SPLASH splash10-0f6x-9050000000-65c9f5532d7dd3d95150
Source of Spectrum NP-11-1177-0
Wiley ID 1109398