| SpectraBase Spectrum ID |
D4jdLOoUpUw |
| Name |
(1R,5S,E)-2-Methyl-4-(2,5,6,6-tetramethylcyclohex-2-en-1-yl)-but-2-enal |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
220.182715392 u |
| Formula |
C15H24O |
| InChI |
InChI=1S/C15H24O/c1-11(10-16)6-9-14-12(2)7-8-13(3)15(14,4)5/h6-7,10,13-14H,8-9H2,1-5H3/b11-6+/t13-,14+/m1/s1 |
| InChIKey |
MDRHHPDGZDUMAW-BLOBHPOZSA-N |
| Molecular Weight |
220.356 g/mol |
| SMILES |
C(=O)\C(=C\C[C@@]1(C([C@@](CC=C1C)(C)[H])(C)C)[H])C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.892776 |
