SpectraBase Spectrum ID |
DRqIu6PJJDE |
Name |
1-Methoxy-4-(propa-1,2-dienoxymethyl)benzene |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
177.091554657 u |
Formula |
C11H13O2 |
InChI |
InChI=1S/C11H12O2/c1-3-8-13-9-10-4-6-11(12-2)7-5-10/h4-8H,1,9H2,2H3 |
InChIKey |
PVFQCEJTWYDXHY-UHFFFAOYSA-N |
Molecular Weight |
177.223 g/mol |
Nominal Mass |
177 u |
SMILES |
[CH3]=C=COCC=1C=CC(=CC1)OC |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.94033 |