SpectraBase Spectrum ID |
6Wykv6DCcVF |
Name |
1,4-Dihydroxy-2,5-di-(3-methyl-2-buten-1-yl)-benzene |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
246.161979946 u |
Formula |
C16H22O2 |
InChI |
InChI=1S/C16H22O2/c1-11(2)5-7-13-9-16(18)14(10-15(13)17)8-6-12(3)4/h5-6,9-10,17-18H,7-8H2,1-4H3 |
InChIKey |
BMICBONXHMTZEU-UHFFFAOYSA-N |
Molecular Weight |
246.350 g/mol |
SMILES |
C1(O)=C(C=C(O)C(=C1)CC=C(C)C)CC=C(C)C |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.935994 |