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3'-hydroxy-5'-pentylphenyl 4-benzyloxy-2-hydroxy-6-pentylbenzoate
SpectraBase Compound ID FoBTxE5V89G
InChI InChI=1S/C30H36O5/c1-3-5-8-14-23-16-25(31)19-27(17-23)35-30(33)29-24(15-9-6-4-2)18-26(20-28(29)32)34-21-22-12-10-7-11-13-22/h7,10-13,16-20,31-32H,3-6,8-9,14-15,21H2,1-2H3
InChIKey DNBSCOZWUCVFIK-UHFFFAOYSA-N
Mol Weight 476.6 g/mol
Molecular Formula C30H36O5
Exact Mass 476.256274 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AkEt46VrmAw
Name 3'-hydroxy-5'-pentylphenyl 4-benzyloxy-2-hydroxy-6-pentylbenzoate
Comments Less than 3 mono-isotopic peaks
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Formula C30H36O5
InChI InChI=1S/C30H36O5/c1-3-5-8-14-23-16-25(31)19-27(17-23)35-30(33)29-24(15-9-6-4-2)18-26(20-28(29)32)34-21-22-12-10-7-11-13-22/h7,10-13,16-20,31-32H,3-6,8-9,14-15,21H2,1-2H3
InChIKey DNBSCOZWUCVFIK-UHFFFAOYSA-N
Molecular Weight 476.613 g/mol
SMILES Oc1cc(OC(c2c(cc(cc2CCCCC)OCc2ccccc2)O)=O)cc(c1)CCCCC
SPLASH splash10-0002-0090000000-ac0713c63b5238eb502e
Source of Spectrum JA-50-1145-0
Synonyms 3-hydroxy-5-pentylphenyl 4-(benzyloxy)-2-hydroxy-6-pentylbenzoate
Wiley ID 1394426