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Benzoic acid, 4-(undecyloxy)-, 4-(2-ethoxypropoxy)phenyl ester, (S)-
SpectraBase Compound ID KDO9mvvjEJt
InChI InChI=1S/C29H42O5/c1-4-6-7-8-9-10-11-12-13-22-32-26-16-14-25(15-17-26)29(30)34-28-20-18-27(19-21-28)33-23-24(3)31-5-2/h14-21,24H,4-13,22-23H2,1-3H3/t24-/m0/s1
InChIKey BWXIIZIEPBCLRF-DEOSSOPVSA-N
Mol Weight 470.7 g/mol
Molecular Formula C29H42O5
Exact Mass 470.303224 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Ha69aLWXwyS
Name Benzoic acid, 4-(undecyloxy)-, 4-(2-ethoxypropoxy)phenyl ester, (S)-
CAS Registry Number 103239-92-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C29H42O5
InChI InChI=1S/C29H42O5/c1-4-6-7-8-9-10-11-12-13-22-32-26-16-14-25(15-17-26)29(30)34-28-20-18-27(19-21-28)33-23-24(3)31-5-2/h14-21,24H,4-13,22-23H2,1-3H3/t24-/m0/s1
InChIKey BWXIIZIEPBCLRF-DEOSSOPVSA-N
Molecular Weight 470.650 g/mol
SMILES C(Oc1ccc(OC[C@@](OCC)(C)[H])cc1)(c1ccc(cc1)OCCCCCCCCCCC)=O
SPLASH splash10-00b9-0590100000-12a6389667dccaf64741
Source of Spectrum C-108-5220-0
Synonyms 4-{[(2S)-2-ethoxypropyl]oxy}phenyl 4-(undecyloxy)benzoate
Wiley ID 1392924