SpectraBase Compound ID | FdhoSRc6ltv |
---|---|
InChI | InChI=1S/C8H15NO/c1-2-8(10)6-4-3-5-7(8)9/h2,7,10H,1,3-6,9H2/t7-,8+/m0/s1 |
InChIKey | LZKOLMJUTKEOTE-JGVFFNPUSA-N |
Mol Weight | 141.21 g/mol |
Molecular Formula | C8H15NO |
Exact Mass | 141.115364 g/mol |
SpectraBase Spectrum ID | HG5pWScnm0W |
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Name | (1S,2S)-2-Amino-1-ethenyl-1-cyclohexanol |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 141.115364106 u |
Formula | C8H15NO |
InChI | InChI=1S/C8H15NO/c1-2-8(10)6-4-3-5-7(8)9/h2,7,10H,1,3-6,9H2/t7-,8+/m0/s1 |
InChIKey | LZKOLMJUTKEOTE-JGVFFNPUSA-N |
Molecular Weight | 141.214 g/mol |
SMILES | [C@]1(C=C)([C@@](N)(CCCC1)[H])O |
Spectrum/Structure Validation Score (Vapor Phase IR) | 0.873248 |