SpectraBase Spectrum ID |
5seimbOB0oM |
Name |
(S)-1-Methyl-9-( 2',4'-dimethoxyphenyl)bicyclo[4.3.0]nona-6,8-diene |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
270.161979946 u |
Formula |
C18H22O2 |
InChI |
InChI=1S/C18H22O2/c1-18-11-5-4-6-13(18)7-10-16(18)15-9-8-14(19-2)12-17(15)20-3/h7-10,12H,4-6,11H2,1-3H3/t18-/m0/s1 |
InChIKey |
WETVCYNQZFDPAH-SFHVURJKSA-N |
Molecular Weight |
270.372 g/mol |
SMILES |
C=1([C@@]2(C(CCCC2)=CC1)C)C=1C(=CC(=CC1)OC)OC |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.812109 |