| SpectraBase Spectrum ID |
63ZAyO0UJJ0 |
| Name |
(2R)-1-Benzyloxy-2-(methoxymethoxy)-15-methyl-4-hexadecyne |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
402.313395209 u |
| Formula |
C26H42O3 |
| InChI |
InChI=1S/C26H42O3/c1-24(2)17-13-10-8-6-4-5-7-9-11-16-20-26(29-23-27-3)22-28-21-25-18-14-12-15-19-25/h12,14-15,18-19,24,26H,4-10,13,17,20-23H2,1-3H3/t26-/m1/s1 |
| InChIKey |
NVIKXHGEKJWJHT-AREMUKBSSA-N |
| Molecular Weight |
402.619 g/mol |
| SMILES |
C([C@@](CC#CCCCCCCCCCC(C)C)(OCOC)[H])OCC=1C=CC=CC1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.840285 |
