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Benzoic acid, 4-(undecyloxy)-, 4-(2-propoxypropoxy)phenyl ester, (S)-
SpectraBase Compound ID 8qjZqz0eqME
InChI InChI=1S/C30H44O5/c1-4-6-7-8-9-10-11-12-13-23-33-27-16-14-26(15-17-27)30(31)35-29-20-18-28(19-21-29)34-24-25(3)32-22-5-2/h14-21,25H,4-13,22-24H2,1-3H3/t25-/m0/s1
InChIKey OJJAKQMMZQQXLE-VWLOTQADSA-N
Mol Weight 484.7 g/mol
Molecular Formula C30H44O5
Exact Mass 484.318875 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 37OCPIwNBOR
Name Benzoic acid, 4-(undecyloxy)-, 4-(2-propoxypropoxy)phenyl ester, (S)-
CAS Registry Number 103239-93-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C30H44O5
InChI InChI=1S/C30H44O5/c1-4-6-7-8-9-10-11-12-13-23-33-27-16-14-26(15-17-27)30(31)35-29-20-18-28(19-21-29)34-24-25(3)32-22-5-2/h14-21,25H,4-13,22-24H2,1-3H3/t25-/m0/s1
InChIKey OJJAKQMMZQQXLE-VWLOTQADSA-N
Molecular Weight 484.677 g/mol
SMILES C(Oc1ccc(OC[C@@](OCCC)(C)[H])cc1)(c1ccc(cc1)OCCCCCCCCCCC)=O
SPLASH splash10-00b9-0790200000-af8b5add0bfd25b6e441
Source of Spectrum C-108-5220-0
Synonyms 4-{[(2S)-2-propoxypropyl]oxy}phenyl 4-(undecyloxy)benzoate
Wiley ID 1396112