| SpectraBase Compound ID | JXIzYf0h83t |
|---|---|
| InChI | InChI=1S/C10H16O/c1-7(2)10-6-9(11)5-4-8(10)3/h6-8H,4-5H2,1-3H3/t8-/m0/s1 |
| InChIKey | MSFIFKKMQXGGGT-QMMMGPOBSA-N |
| Mol Weight | 152.24 g/mol |
| Molecular Formula | C10H16O |
| Exact Mass | 152.120115 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 3vGu7rjDeI2 |
|---|---|
| Name | (S)-3-Isopropyl-4-methylcyclohex-2-en-1-one |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 152.120115134 u |
| Formula | C10H16O |
| InChI | InChI=1S/C10H16O/c1-7(2)10-6-9(11)5-4-8(10)3/h6-8H,4-5H2,1-3H3/t8-/m0/s1 |
| InChIKey | MSFIFKKMQXGGGT-QMMMGPOBSA-N |
| Molecular Weight | 152.237 g/mol |
| SMILES | C1(=CC(=O)CC[C@@]1(C)[H])C(C)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.951079 |