| SpectraBase Spectrum ID |
1IHZ7AmjyCU |
| Name |
2H-1-Benzopyran-6-ol, 3,4-dihydro-2,2-dimethyl-4-(1-methylethyl)-7-octyl- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
332.271530397 u |
| Formula |
C22H36O2 |
| InChI |
InChI=1S/C22H36O2/c1-6-7-8-9-10-11-12-17-13-21-18(14-20(17)23)19(16(2)3)15-22(4,5)24-21/h13-14,16,19,23H,6-12,15H2,1-5H3 |
| InChIKey |
JYZPSBQSMQQYOB-UHFFFAOYSA-N |
| Molecular Weight |
332.528 g/mol |
| SMILES |
CCCCCCCCC1=CC=2OC(C)(C)CC(C2C=C1O)C(C)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.911789 |
