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Carbonic acid, monoamide, N-hept-2-yl-, 3-chloropropyl ester

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Carbonic acid, monoamide, N-hept-2-yl-, 3-chloropropyl ester
SpectraBase Compound ID DqZIq55lubE
InChI InChI=1S/C11H22ClNO2/c1-3-4-5-7-10(2)13-11(14)15-9-6-8-12/h10H,3-9H2,1-2H3,(H,13,14)
InChIKey UWCIYQQCORPUAB-UHFFFAOYSA-N
Mol Weight 235.75 g/mol
Molecular Formula C11H22ClNO2
Exact Mass 235.133907 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID EE7KG1iNwDG
Name Carbonic acid, monoamide, N-hept-2-yl-, 3-chloropropyl ester
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 235.133906650 u
Formula C11H22ClNO2
InChI InChI=1S/C11H22ClNO2/c1-3-4-5-7-10(2)13-11(14)15-9-6-8-12/h10H,3-9H2,1-2H3,(H,13,14)
InChIKey UWCIYQQCORPUAB-UHFFFAOYSA-N
Molecular Weight 235.755 g/mol
SMILES C(CC(C)NC(OCCCCl)=O)CCC
Spectrum/Structure Validation Score (Vapor Phase IR) 0.90729