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Carbamic acid, 1,3-pentadienyl-, ethyl ester, (E,E)-

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Carbamic acid, 1,3-pentadienyl-, ethyl ester, (E,E)-
SpectraBase Compound ID DJnHDVtaxOC
InChI InChI=1S/C8H13NO2/c1-3-5-6-7-9-8(10)11-4-2/h3,5-7H,4H2,1-2H3,(H,9,10)/b5-3+,7-6+
InChIKey IHDKVLCSSSTMLG-TWTPFVCWSA-N
Mol Weight 155.2 g/mol
Molecular Formula C8H13NO2
Exact Mass 155.094629 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 5BXQQa8pFB5
Name Carbamic acid, 1,3-pentadienyl-, ethyl ester, (E,E)-
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 155.094628661 u
Formula C8H13NO2
InChI InChI=1S/C8H13NO2/c1-3-5-6-7-9-8(10)11-4-2/h3,5-7H,4H2,1-2H3,(H,9,10)/b5-3+,7-6+
InChIKey IHDKVLCSSSTMLG-TWTPFVCWSA-N
Molecular Weight 155.197 g/mol
SMILES C(=O)(N\C=C\C=C\C)OCC
Spectrum/Structure Validation Score (Vapor Phase IR) 0.801875