SpectraBase Compound ID | HGpos2la2h0 |
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InChI | InChI=1S/C11H17N/c1-3-9(2)11(12)10-7-5-4-6-8-10/h4-9,11H,3,12H2,1-2H3 |
InChIKey | PCELVXFUVRHMRO-UHFFFAOYSA-N |
Mol Weight | 163.26 g/mol |
Molecular Formula | C11H17N |
Exact Mass | 163.1361 g/mol |
SpectraBase Spectrum ID | NNOLUz6Ztw |
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Name | A-sec-Butylbenzylamine |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 163.136099551 u |
Formula | C11H17N |
InChI | InChI=1S/C11H17N/c1-3-9(2)11(12)10-7-5-4-6-8-10/h4-9,11H,3,12H2,1-2H3 |
InChIKey | PCELVXFUVRHMRO-UHFFFAOYSA-N |
Molecular Weight | 163.264 g/mol |
SMILES | NC(C1=CC=CC=C1)C(CC)C |
Spectrum/Structure Validation Score (Raman) | 0.9856 |