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Carbonic acid, monoamide, N-hept-2-yl-, hexyl ester

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Carbonic acid, monoamide, N-hept-2-yl-, hexyl ester
SpectraBase Compound ID Hvc0PVUkUwq
InChI InChI=1S/C14H29NO2/c1-4-6-8-10-12-17-14(16)15-13(3)11-9-7-5-2/h13H,4-12H2,1-3H3,(H,15,16)
InChIKey YZSWAQDNAALBIZ-UHFFFAOYSA-N
Mol Weight 243.39 g/mol
Molecular Formula C14H29NO2
Exact Mass 243.219829 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 1s9xe6g6FWy
Name Carbonic acid, monoamide, N-hept-2-yl-, hexyl ester
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 243.219829176 u
Formula C14H29NO2
InChI InChI=1S/C14H29NO2/c1-4-6-8-10-12-17-14(16)15-13(3)11-9-7-5-2/h13H,4-12H2,1-3H3,(H,15,16)
InChIKey YZSWAQDNAALBIZ-UHFFFAOYSA-N
Molecular Weight 243.391 g/mol
SMILES C(NC(CCCCC)C)(=O)OCCCCCC
Spectrum/Structure Validation Score (Vapor Phase IR) 0.892168