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(phenylmethyl) 2-[(16R)-16-oxidanylheptadecyl]-6-phenylmethoxy-benzoate
SpectraBase Compound ID CRK0cYUfggH
InChI InChI=1S/C38H52O4/c1-32(39)22-15-11-9-7-5-3-2-4-6-8-10-12-20-27-35-28-21-29-36(41-30-33-23-16-13-17-24-33)37(35)38(40)42-31-34-25-18-14-19-26-34/h13-14,16-19,21,23-26,28-29,32,39H,2-12,15,20,22,27,30-31H2,1H3/t32-/m1/s1
InChIKey UHGPVIWOPFOEIB-JGCGQSQUSA-N
Mol Weight 572.8 g/mol
Molecular Formula C38H52O4
Exact Mass 572.38656 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 76QG8kzBqPi
Name (phenylmethyl) 2-[(16R)-16-oxidanylheptadecyl]-6-phenylmethoxy-benzoate
Alternate Name(s) 2-Benzoxy-6-[(16R)-16-hydroxyheptadecyl]benzoic acid benzyl ester 2-[(16R)-16-hydroxyheptadecyl]-6-phenylmethoxybenzoic acid (phenylmethyl) ester benzyl 2-[(16R)-16-hydroxyheptadecyl]-6-phenylmethoxybenzoate
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Formula C38H52O4
InChI InChI=1S/C38H52O4/c1-32(39)22-15-11-9-7-5-3-2-4-6-8-10-12-20-27-35-28-21-29-36(41-30-33-23-16-13-17-24-33)37(35)38(40)42-31-34-25-18-14-19-26-34/h13-14,16-19,21,23-26,28-29,32,39H,2-12,15,20,22,27,30-31H2,1H3/t32-/m1/s1
InChIKey UHGPVIWOPFOEIB-JGCGQSQUSA-N
Molecular Weight 572.830 g/mol
SMILES O[C@@](CCCCCCCCCCCCCCCc1c(C(OCc2ccccc2)=O)c(OCc2ccccc2)ccc1)(C)[H]
SPLASH splash10-0006-9102000000-912a925d8998634bf69f
Source of Spectrum J-63-3077-10
Wiley ID 1407920