| SpectraBase Spectrum ID |
4Xy9nUAEspI |
| Name |
Benzyl phytyl ether |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
386.354866100 u |
| Formula |
C27H46O |
| InChI |
InChI=1S/C27H46O/c1-23(2)12-9-13-24(3)14-10-15-25(4)16-11-17-26(5)20-21-28-22-27-18-7-6-8-19-27/h6-8,18-20,23-25H,9-17,21-22H2,1-5H3/b26-20-/t24-,25-/m1/s1 |
| InChIKey |
IGADAXBJFIZWKE-ZKNBASQJSA-N |
| Molecular Weight |
386.664 g/mol |
| SMILES |
C(OCC1=CC=CC=C1)\C=C/(CCC[C@@](CCC[C@@](CCCC(C)C)(C)[H])(C)[H])C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.840134 |
