| SpectraBase Spectrum ID |
JDSngEzyq5z |
| Name |
1-[4-(1-Butyl-2,2,3,3-tetramethyl-cyclopropyl)phenyl]ethanone |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
272.214015521 u |
| Formula |
C19H28O |
| InChI |
InChI=1S/C19H28O/c1-7-8-13-19(17(3,4)18(19,5)6)16-11-9-15(10-12-16)14(2)20/h9-12H,7-8,13H2,1-6H3 |
| InChIKey |
LJGLZFOAKYVBCD-UHFFFAOYSA-N |
| Molecular Weight |
272.432 g/mol |
| SMILES |
C1(C(C)(C)C1(C=1C=CC(=CC1)C(=O)C)CCCC)(C)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.905858 |
![1-[4-(1-Butyl-2,2,3,3-tetramethyl-cyclopropyl)phenyl]ethanone](/api/spectrum/JDSngEzyq5z/structure.png?h=300&w=458 "1-[4-(1-Butyl-2,2,3,3-tetramethyl-cyclopropyl)phenyl]ethanone")
