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Isonipecotic acid, N-methacryloyl-, tridecyl ester

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Isonipecotic acid, N-methacryloyl-, tridecyl ester
SpectraBase Compound ID 9Vpj03XooBr
InChI InChI=1S/C23H41NO3/c1-4-5-6-7-8-9-10-11-12-13-14-19-27-23(26)21-15-17-24(18-16-21)22(25)20(2)3/h21H,2,4-19H2,1,3H3
InChIKey LMCWODILWZDKGP-UHFFFAOYSA-N
Mol Weight 379.6 g/mol
Molecular Formula C23H41NO3
Exact Mass 379.308644 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID Gpr0FXwyreV
Name Isonipecotic acid, N-methacryloyl-, tridecyl ester
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 379.308644181 u
Formula C23H41NO3
InChI InChI=1S/C23H41NO3/c1-4-5-6-7-8-9-10-11-12-13-14-19-27-23(26)21-15-17-24(18-16-21)22(25)20(2)3/h21H,2,4-19H2,1,3H3
InChIKey LMCWODILWZDKGP-UHFFFAOYSA-N
Molecular Weight 379.585 g/mol
SMILES CCCCCCCCCCCCCOC(C1CCN(C(=O)C(=C)C)CC1)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.955022