| SpectraBase Spectrum ID |
3586CT6XIUy |
| Name |
1H-Indene-1-carboxaldehyde, 2,3,3A,4,7,7A-hexahydro-2-methoxy-, (1.alpha.,2.beta.,3A.beta.,7A.alpha.)- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
180.115029753 u |
| Formula |
C11H16O2 |
| InChI |
InChI=1S/C11H16O2/c1-13-11-6-8-4-2-3-5-9(8)10(11)7-12/h2-3,7-11H,4-6H2,1H3/t8-,9+,10-,11-/m0/s1 |
| InChIKey |
IPLNHBBPQINRQM-VLEAKVRGSA-N |
| Molecular Weight |
180.247 g/mol |
| SMILES |
[C@]1([C@]2([C@](CC=CC2)([H])C[C@@]1(OC)[H])[H])(C=O)[H] |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.96099 |
