SpectraBase Compound ID | EaP55YFCBp2 |
---|---|
InChI | InChI=1S/C8H16O/c1-3-4-5-6-8(2)7-9/h3,8-9H,1,4-7H2,2H3/t8-/m0/s1 |
InChIKey | UVGLIWCAMUOQPL-QMMMGPOBSA-N |
Mol Weight | 128.21 g/mol |
Molecular Formula | C8H16O |
Exact Mass | 128.120115 g/mol |
SpectraBase Spectrum ID | LRB177KChau |
---|---|
Name | (2S)-2-Methyl-6-hepten-1-ol |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 128.120115134 u |
Formula | C8H16O |
InChI | InChI=1S/C8H16O/c1-3-4-5-6-8(2)7-9/h3,8-9H,1,4-7H2,2H3/t8-/m0/s1 |
InChIKey | UVGLIWCAMUOQPL-QMMMGPOBSA-N |
Molecular Weight | 128.215 g/mol |
SMILES | C(=C)CCC[C@@](CO)(C)[H] |
Spectrum/Structure Validation Score (Vapor Phase IR) | 0.883807 |