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Carbonic acid, monoamide, N-heptyl-, 2-ethylhexyl ester

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Carbonic acid, monoamide, N-heptyl-, 2-ethylhexyl ester
SpectraBase Compound ID Dn1HdavMAGS
InChI InChI=1S/C16H33NO2/c1-4-7-9-10-11-13-17-16(18)19-14-15(6-3)12-8-5-2/h15H,4-14H2,1-3H3,(H,17,18)
InChIKey VHAZCDXZCCFPBY-UHFFFAOYSA-N
Mol Weight 271.4 g/mol
Molecular Formula C16H33NO2
Exact Mass 271.251129 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID EFerOpWIeL2
Name Carbonic acid, monoamide, N-heptyl-, 2-ethylhexyl ester
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 271.251129305 u
Formula C16H33NO2
InChI InChI=1S/C16H33NO2/c1-4-7-9-10-11-13-17-16(18)19-14-15(6-3)12-8-5-2/h15H,4-14H2,1-3H3,(H,17,18)
InChIKey VHAZCDXZCCFPBY-UHFFFAOYSA-N
SMILES C(NCCCCCCC)(=O)OCC(CCCC)CC
Spectrum/Structure Validation Score (Vapor Phase IR) 0.977043