SpectraBase Compound ID | 2mbLXLVLhCO |
---|---|
InChI | InChI=1S/C9H17N/c1-9-6-3-2-4-8(9)5-7-10-9/h8,10H,2-7H2,1H3/t8-,9-/m1/s1 |
InChIKey | ZVOASTANJHXEJU-RKDXNWHRSA-N |
Mol Weight | 139.24 g/mol |
Molecular Formula | C9H17N |
Exact Mass | 139.1361 g/mol |
SpectraBase Spectrum ID | yFkkVHfevI |
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Name | (+-)-(1R*,6R*)-9-aza-1-methylbicyclo[4.3.0]nonane |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 139.136099551 u |
Formula | C9H17N |
InChI | InChI=1S/C9H17N/c1-9-6-3-2-4-8(9)5-7-10-9/h8,10H,2-7H2,1H3/t8-,9-/m1/s1 |
InChIKey | ZVOASTANJHXEJU-RKDXNWHRSA-N |
Molecular Weight | 139.242 g/mol |
SMILES | [C@]12(NCC[C@]2(CCCC1)[H])C |
Spectrum/Structure Validation Score (Vapor Phase IR) | 0.891071 |