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Vitamin K5, N,o-di(acetyl)-

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Vitamin K5, N,o-di(acetyl)-
SpectraBase Compound ID GcEf3hMDMGN
InChI InChI=1S/C15H15NO3/c1-9-8-14(16-10(2)17)12-6-4-5-7-13(12)15(9)19-11(3)18/h4-8H,1-3H3,(H,16,17)
InChIKey ANVJEJHWFGCDCW-UHFFFAOYSA-N
Mol Weight 257.29 g/mol
Molecular Formula C15H15NO3
Exact Mass 257.105193 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID BRgCGOZ3Q94
Name Vitamin K5, N,o-di(acetyl)-
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 257.105193344 u
Formula C15H15NO3
InChI InChI=1S/C15H15NO3/c1-9-8-14(16-10(2)17)12-6-4-5-7-13(12)15(9)19-11(3)18/h4-8H,1-3H3,(H,16,17)
InChIKey ANVJEJHWFGCDCW-UHFFFAOYSA-N
Molecular Weight 257.289 g/mol
SMILES C12=C(C=C(C(=C2C=CC=C1)OC(C)=O)C)NC(C)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.949912