| SpectraBase Spectrum ID |
76GjjTS39gp |
| Name |
2-{Bicyclo[2.2.1]heptan-2-yl}-4-tert-butylphenol |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
244.182715392 u |
| Formula |
C17H24O |
| InChI |
InChI=1S/C17H24O/c1-17(2,3)13-6-7-16(18)15(10-13)14-9-11-4-5-12(14)8-11/h6-7,10-12,14,18H,4-5,8-9H2,1-3H3/t11-,12+,14-/m1/s1 |
| InChIKey |
QPLVBFMXIVUKQD-MBNYWOFBSA-N |
| Molecular Weight |
244.378 g/mol |
| SMILES |
C1=C(C(=CC(=C1)C(C)(C)C)[C@@]1(C[C@@]2(CC[C@]1(C2)[H])[H])[H])O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.825469 |
![2-{Bicyclo[2.2.1]heptan-2-yl}-4-tert-butylphenol](/api/spectrum/76GjjTS39gp/structure.png?h=300&w=458 "2-{Bicyclo[2.2.1]heptan-2-yl}-4-tert-butylphenol")
