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Benzoic acid, 2-hydroxy-6-pentyl-4-(phenylmethoxy)-, methyl ester
SpectraBase Compound ID DTBssbq3DdL
InChI InChI=1S/C20H24O4/c1-3-4-6-11-16-12-17(13-18(21)19(16)20(22)23-2)24-14-15-9-7-5-8-10-15/h5,7-10,12-13,21H,3-4,6,11,14H2,1-2H3
InChIKey FSZQIAITRRNLJI-UHFFFAOYSA-N
Mol Weight 328.41 g/mol
Molecular Formula C20H24O4
Exact Mass 328.167459 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Lc96AJidI6f
Name Benzoic acid, 2-hydroxy-6-pentyl-4-(phenylmethoxy)-, methyl ester
Alternate Name(s) 2-hydroxy-6-pentyl-4-phenylmethoxybenzoic acid methyl ester methyl 2-hydroxy-6-pentyl-4-phenylmethoxybenzoate methyl 4-benzyloxy-2-hydroxy-6-pentyl-benzoate methyl 2-oxidanyl-6-pentyl-4-phenylmethoxy-benzoate
CAS Registry Number 94103-01-2
Comments Less than 3 mono-isotopic peaks
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Formula C20H24O4
InChI InChI=1S/C20H24O4/c1-3-4-6-11-16-12-17(13-18(21)19(16)20(22)23-2)24-14-15-9-7-5-8-10-15/h5,7-10,12-13,21H,3-4,6,11,14H2,1-2H3
InChIKey FSZQIAITRRNLJI-UHFFFAOYSA-N
Molecular Weight 328.408 g/mol
SMILES Oc1c(c(cc(OCc2ccccc2)c1)CCCCC)C(=O)OC
SPLASH splash10-0006-9000000000-e57083cb61462ec87983
Source of Spectrum B-40-1460-28
Wiley ID 1326518