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(4S)-4,5-Dihydro-2-[4'-(4"-decyloxy-benzoyloxy)-2'-hydroxy-phenyl]-4-methyl-oxazole
SpectraBase Compound ID 5vxxyx2F9ne
InChI InChI=1S/C27H35NO5/c1-3-4-5-6-7-8-9-10-17-31-22-13-11-21(12-14-22)27(30)33-23-15-16-24(25(29)18-23)26-28-20(2)19-32-26/h11-16,18,20,29H,3-10,17,19H2,1-2H3/t20-/m0/s1
InChIKey KEEOGVKFCOOEKZ-FQEVSTJZSA-N
Mol Weight 453.6 g/mol
Molecular Formula C27H35NO5
Exact Mass 453.251523 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AweGDYYlXvm
Name (4S)-4,5-Dihydro-2-[4'-(4"-decyloxy-benzoyloxy)-2'-hydroxy-phenyl]-4-methyl-oxazole
Alternate Name(s) (4S)-4,5-Dihydro-2-[4'-(4''-decyloxybenzoyloxy)phenyl]-4-methyloxazole (4S)-4,5-Dihydro-2-[4'-(4''-decyloxy-benzoyloxy)-2'-hydroxy-phenyl]-4-methyl-oxazole (4S)-4,5-Dihydro-2-[4'-(4''-decyloxybenzoyloxy)phenyl]-4-methyloxazole 3-Hydroxy-4-[(4S)-4-methyl-4,5-dihydro-1,3-oxazol-2-yl]phenyl 4-(decyloxy)benzoate
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Formula C27H35NO5
InChI InChI=1S/C27H35NO5/c1-3-4-5-6-7-8-9-10-17-31-22-13-11-21(12-14-22)27(30)33-23-15-16-24(25(29)18-23)26-28-20(2)19-32-26/h11-16,18,20,29H,3-10,17,19H2,1-2H3/t20-/m0/s1
InChIKey KEEOGVKFCOOEKZ-FQEVSTJZSA-N
Molecular Weight 453.579 g/mol
SMILES Oc1c(C2=N[C@@](C)(CO2)[H])ccc(OC(c2ccc(cc2)OCCCCCCCCCC)=O)c1
SPLASH splash10-03k9-0590100000-d30c3b4e9ca3a24c5883
Source of Spectrum C-117-8320-0
Wiley ID 758991