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(4S)-4,5-Dihydro-2-(4'-decyloxy-2'-hydroxyphenyl])-4-isopropyloxazole
SpectraBase Compound ID DxhEhPOcoMH
InChI InChI=1S/C22H35NO3/c1-4-5-6-7-8-9-10-11-14-25-18-12-13-19(21(24)15-18)22-23-20(16-26-22)17(2)3/h12-13,15,17,20,24H,4-11,14,16H2,1-3H3/t20-/m1/s1
InChIKey UHMFOCSSMPIMAR-HXUWFJFHSA-N
Mol Weight 361.5 g/mol
Molecular Formula C22H35NO3
Exact Mass 361.261694 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AHC7r4NulIe
Name (4S)-4,5-Dihydro-2-(4'-decyloxy-2'-hydroxyphenyl])-4-isopropyloxazole
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Formula C22H35NO3
InChI InChI=1S/C22H35NO3/c1-4-5-6-7-8-9-10-11-14-25-18-12-13-19(21(24)15-18)22-23-20(16-26-22)17(2)3/h12-13,15,17,20,24H,4-11,14,16H2,1-3H3/t20-/m1/s1
InChIKey UHMFOCSSMPIMAR-HXUWFJFHSA-N
Molecular Weight 361.526 g/mol
SMILES Oc1c(C2=N[C@@](C(C)C)(CO2)[H])ccc(OCCCCCCCCCC)c1
SPLASH splash10-014i-1109000000-00597ecae3991bba2344
Source of Spectrum C-117-8320-0
Wiley ID 758989