| SpectraBase Spectrum ID |
9YXZOFvcIXn |
| Name |
(3S)-3-Benzyloxy-1-heptene |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
204.151415263 u |
| Formula |
C14H20O |
| InChI |
InChI=1S/C14H20O/c1-3-5-11-14(4-2)15-12-13-9-7-6-8-10-13/h4,6-10,14H,2-3,5,11-12H2,1H3/t14-/m1/s1 |
| InChIKey |
MFLBBFQTUOEHBY-CQSZACIVSA-N |
| Molecular Weight |
204.313 g/mol |
| SMILES |
C(=C)[C@@](OCC=1C=CC=CC1)(CCCC)[H] |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.939176 |