| SpectraBase Spectrum ID |
1iOSPx0OmdA |
| Name |
3-[(1S,6R)-1,3,3,6-Tetramethyl-2,4,5,6-tetrahydropentalen-1-yl]propanal |
| 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/c1-11-6-7-12-13(11)15(4,8-5-9-16)10-14(12,2)3/h9,11H,5-8,10H2,1-4H3/t11-,15+/m1/s1 |
| InChIKey |
TVWVYCPEJPPGTH-ABAIWWIYSA-N |
| Molecular Weight |
220.356 g/mol |
| SMILES |
C12=C([C@](CCC=O)(C)CC2(C)C)[C@](C)(CC1)[H] |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.955733 |
![3-[(1S,6R)-1,3,3,6-tetramethyl-2,4,5,6-tetrahydropentalen-1-yl]propanal](/api/spectrum/1iOSPx0OmdA/structure.png?h=300&w=458 "3-[(1S,6R)-1,3,3,6-tetramethyl-2,4,5,6-tetrahydropentalen-1-yl]propanal")
