SpectraBase Compound ID | 4CO7c1yuWPv |
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InChI | InChI=1S/C9H15N/c1-2-7-10-8-5-3-4-6-9(8)10/h2,8-9H,1,3-7H2 |
InChIKey | PNFBQPFMGNUCHO-UHFFFAOYSA-N |
Mol Weight | 137.23 g/mol |
Molecular Formula | C9H15N |
Exact Mass | 137.120449 g/mol |
SpectraBase Spectrum ID | Ac2M4CqF8ZI |
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Name | 7-Allyl-7-azabicyclo[4.1.0]heptane |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 137.120449487 u |
Formula | C9H15N |
InChI | InChI=1S/C9H15N/c1-2-7-10-8-5-3-4-6-9(8)10/h2,8-9H,1,3-7H2 |
InChIKey | PNFBQPFMGNUCHO-UHFFFAOYSA-N |
Molecular Weight | 137.226 g/mol |
SMILES | C12N(C1CCCC2)CC=C |
Spectrum/Structure Validation Score (Vapor Phase IR) | 0.948641 |