| SpectraBase Spectrum ID |
2aCDKikICah |
| Name |
Benzoic acid, 4-(dodecyloxy)-, 4-(2-methoxypropoxy)phenyl ester, (S)- |
| Alternate Name(s) |
4-{[(2S)-2-methoxypropyl]oxy}phenyl 4-(dodecyloxy)benzoate |
| CAS Registry Number |
103239-94-7 |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C29H42O5 |
| InChI |
InChI=1S/C29H42O5/c1-4-5-6-7-8-9-10-11-12-13-22-32-26-16-14-25(15-17-26)29(30)34-28-20-18-27(19-21-28)33-23-24(2)31-3/h14-21,24H,4-13,22-23H2,1-3H3/t24-/m0/s1 |
| InChIKey |
QWEZVEWFXCFNJW-DEOSSOPVSA-N |
| Molecular Weight |
470.650 g/mol |
| SMILES |
C(Oc1ccc(OC[C@@](OC)(C)[H])cc1)(c1ccc(cc1)OCCCCCCCCCCCC)=O |
| SPLASH |
splash10-0006-0090300000-ae0a5428f2622354d141 |
| Source of Spectrum |
C-108-5220-0 |
| Wiley ID |
1392925 |
