| SpectraBase Spectrum ID |
6L3SRccWXLd |
| Name |
Isoprenoid [1-(2,3-dimethylphenyl)-3-methyl-4-[2-[2-(2,3-dimethylphenyl)ethyl]phenyl]butane] |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
398.297351224 u |
| Formula |
C30H38 |
| InChI |
InChI=1S/C30H38/c1-21(13-15-27-11-7-9-23(3)25(27)5)19-30-20-22(2)14-16-29(30)18-17-28-12-8-10-24(4)26(28)6/h7-12,14,16,20-21H,13,15,17-19H2,1-6H3 |
| InChIKey |
YXNXBTSLHBALAO-UHFFFAOYSA-N |
| Molecular Weight |
398.634 g/mol |
| SMILES |
C1(=C(CCC=2C(=C(C=CC2)C)C)C=CC(=C1)C)CC(CCC1=C(C(=CC=C1)C)C)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.932312 |
![Isoprenoid [1-(2,3-dimethylphenyl)-3-methyl-4-[2-[2-(2,3-dimethylphenyl)ethyl]phenyl]butane]](/api/spectrum/6L3SRccWXLd/structure.png?h=300&w=458 "Isoprenoid [1-(2,3-dimethylphenyl)-3-methyl-4-[2-[2-(2,3-dimethylphenyl)ethyl]phenyl]butane]")
