SpectraBase Compound ID | EvqqntopjGY |
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InChI | InChI=1S/C14H18O/c1-2-3-4-5-6-10-13-15-14-11-8-7-9-12-14/h2,6-12H,1,3-5,13H2/b10-6+ |
InChIKey | DIBTYNFILMOQJH-UXBLZVDNSA-N |
Mol Weight | 202.3 g/mol |
Molecular Formula | C14H18O |
Exact Mass | 202.135765 g/mol |
SpectraBase Spectrum ID | Ga1fPQwlVq2 |
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Name | 1-Phenoxy-2-(E),7-octadiene |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 202.135765199 u |
Formula | C14H18O |
InChI | InChI=1S/C14H18O/c1-2-3-4-5-6-10-13-15-14-11-8-7-9-12-14/h2,6-12H,1,3-5,13H2/b10-6+ |
InChIKey | DIBTYNFILMOQJH-UXBLZVDNSA-N |
Molecular Weight | 202.297 g/mol |
SMILES | C(OC1=CC=CC=C1)\C=C\CCCC=C |
Spectrum/Structure Validation Score (Vapor Phase IR) | 0.93121 |