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Pipecolic acid, N-isobutoxycarbonyl-, decyl ester

View entire compound with spectra: 1 NMR, and 1 FTIR

Pipecolic acid, N-isobutoxycarbonyl-, decyl ester
SpectraBase Compound ID FQILfNhf2vA
InChI InChI=1S/C21H39NO4/c1-4-5-6-7-8-9-10-13-16-25-20(23)19-14-11-12-15-22(19)21(24)26-17-18(2)3/h18-19H,4-17H2,1-3H3
InChIKey FWZMHEJXOOINFT-UHFFFAOYSA-N
Mol Weight 369.5 g/mol
Molecular Formula C21H39NO4
Exact Mass 369.287909 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID IBWrprWbiJD
Name Pipecolic acid, N-isobutoxycarbonyl-, decyl ester
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 369.287908736 u
Formula C21H39NO4
InChI InChI=1S/C21H39NO4/c1-4-5-6-7-8-9-10-13-16-25-20(23)19-14-11-12-15-22(19)21(24)26-17-18(2)3/h18-19H,4-17H2,1-3H3
InChIKey FWZMHEJXOOINFT-UHFFFAOYSA-N
Molecular Weight 369.546 g/mol
SMILES C1CCN(C(C1)C(OCCCCCCCCCC)=O)C(OCC(C)C)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.862087