SpectraBase Compound ID | GYFcFXD1eCL |
---|---|
InChI | InChI=1S/C17H23NO2/c1-13(2)7-6-8-14(3)11-12-20-17(19)15-9-4-5-10-16(15)18/h4-5,7,9-11H,6,8,12,18H2,1-3H3/b14-11+ |
InChIKey | QLRICECRKJGSKQ-SDNWHVSQSA-N |
Mol Weight | 273.38 g/mol |
Molecular Formula | C17H23NO2 |
Exact Mass | 273.172879 g/mol |
SpectraBase Spectrum ID | Fa3SeIudi0z |
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Name | Geranyl anthranilate |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 273.172878983 u |
Formula | C17H23NO2 |
InChI | InChI=1S/C17H23NO2/c1-13(2)7-6-8-14(3)11-12-20-17(19)15-9-4-5-10-16(15)18/h4-5,7,9-11H,6,8,12,18H2,1-3H3/b14-11+ |
InChIKey | QLRICECRKJGSKQ-SDNWHVSQSA-N |
SMILES | C(\C=C\(CCC=C(C)C)C)OC(C1=C(C=CC=C1)N)=O |
Spectrum/Structure Validation Score (Vapor Phase IR) | 0.952455 |