SpectraBase Spectrum ID |
6Qwdjf8ecDV |
Name |
7-Oxabicyclo[3.3.1]non-2-ene, 8-(4-methoxyphenyl)-2,4,9-trimethyl- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
272.177630011 u |
Formula |
C18H24O2 |
InChI |
InChI=1S/C18H24O2/c1-11-9-12(2)17-13(3)16(11)10-20-18(17)14-5-7-15(19-4)8-6-14/h5-9,11,13,16-18H,10H2,1-4H3 |
InChIKey |
DDAOZVNOWMAWFG-UHFFFAOYSA-N |
SMILES |
C1(=CC(C2C(C1C(C1=CC=C(OC)C=C1)OC2)C)C)C |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.945032 |