| SpectraBase Spectrum ID |
DS3g9ICuF5s |
| Name |
p-(Adamantyl-1)phenylcyclopropane |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
252.187800773 u |
| Formula |
C19H24 |
| InChI |
InChI=1S/C19H24/c1-2-14(1)15-3-5-16(6-4-15)19-17-8-12-7-13(10-17)11-18(19)9-12/h3-6,12-14,17-19H,1-2,7-11H2 |
| InChIKey |
CETLNZQOESYFGW-UHFFFAOYSA-N |
| Molecular Weight |
252.401 g/mol |
| SMILES |
C1(C2=CC=C(C3C4CC5CC(C4)CC3C5)C=C2)CC1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.849654 |
