SpectraBase Compound ID | 4mCEru7bT7S |
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InChI | InChI=1S/C12H23N/c1-12(2)10-5-4-9(8-10)11(12)6-7-13-3/h9-11,13H,4-8H2,1-3H3 |
InChIKey | OXVDDBCXEHYZNE-UHFFFAOYSA-N |
Mol Weight | 181.32 g/mol |
Molecular Formula | C12H23N |
Exact Mass | 181.18305 g/mol |
SpectraBase Spectrum ID | CZS5ryBIPHf |
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Name | Bicyclo[2.2.1]heptane-2-ethanamine, N,3,3-trimethyl- |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 181.183049745 u |
Formula | C12H23N |
InChI | InChI=1S/C12H23N/c1-12(2)10-5-4-9(8-10)11(12)6-7-13-3/h9-11,13H,4-8H2,1-3H3 |
InChIKey | OXVDDBCXEHYZNE-UHFFFAOYSA-N |
Molecular Weight | 181.323 g/mol |
SMILES | N(CCC1C2CCC(C1(C)C)C2)C |
Spectrum/Structure Validation Score (Raman) | 0.880802 |