SpectraBase Compound ID | 4qevSqaM3c2 |
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InChI | InChI=1S/C11H14FNO/c12-9-1-3-10(4-2-9)13-11-5-7-14-8-6-11/h1-4,11,13H,5-8H2 |
InChIKey | SPKGJBMEUWFXJD-UHFFFAOYSA-N |
Mol Weight | 195.24 g/mol |
Molecular Formula | C11H14FNO |
Exact Mass | 195.105942 g/mol |
SpectraBase Spectrum ID | Bhzo4HYOxly |
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Name | N-(4-Fluorophenyl)oxan-4-amine |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 195.105942237 u |
Formula | C11H14FNO |
InChI | InChI=1S/C11H14FNO/c12-9-1-3-10(4-2-9)13-11-5-7-14-8-6-11/h1-4,11,13H,5-8H2 |
InChIKey | SPKGJBMEUWFXJD-UHFFFAOYSA-N |
Molecular Weight | 195.237 g/mol |
SMILES | C1COCCC1NC=1C=CC(=CC1)F |
Spectrum/Structure Validation Score (Vapor Phase IR) | 0.83921 |