SpectraBase Compound ID | HOXhBea1VOO |
---|---|
InChI | InChI=1S/C8H17N/c1-6-4-7(2)9-8(3)5-6/h6-9H,4-5H2,1-3H3 |
InChIKey | GELXVDNNZSIRQA-UHFFFAOYSA-N |
Mol Weight | 127.23 g/mol |
Molecular Formula | C8H17N |
Exact Mass | 127.1361 g/mol |
SpectraBase Spectrum ID | 75noDxjtSf0 |
---|---|
Name | Piperidine, 2,4,6-trimethyl- |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 127.136099551 u |
Formula | C8H17N |
InChI | InChI=1S/C8H17N/c1-6-4-7(2)9-8(3)5-6/h6-9H,4-5H2,1-3H3 |
InChIKey | GELXVDNNZSIRQA-UHFFFAOYSA-N |
Molecular Weight | 127.231 g/mol |
SMILES | N1C(CC(CC1C)C)C |
Spectrum/Structure Validation Score (Raman) | 0.762543 |