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1-carbamoyl-N-(p-dimethylaminophenyl)formimidic acid, ethyl ester
SpectraBase Compound ID IbvWZmW63yq
InChI InChI=1S/C12H17N3O2/c1-4-17-12(11(13)16)14-9-5-7-10(8-6-9)15(2)3/h5-8H,4H2,1-3H3,(H2,13,16)/b14-12+
InChIKey JYOAIFPPTKSSCF-WYMLVPIESA-N
Mol Weight 235.29 g/mol
Molecular Formula C12H17N3O2
Exact Mass 235.132077 g/mol

Raman Spectrum

Raman Spectrum

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SpectraBase Spectrum ID 3XLNdaHjK4z
Name 1-Carbamoyl-N-(p-dimethylaminophenyl)formimidic acid, ethyl ester
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 235.132076797 u
Formula C12H17N3O2
InChI InChI=1S/C12H17N3O2/c1-4-17-12(11(13)16)14-9-5-7-10(8-6-9)15(2)3/h5-8H,4H2,1-3H3,(H2,13,16)/b14-12+
InChIKey JYOAIFPPTKSSCF-WYMLVPIESA-N
Molecular Weight 235.287 g/mol
SMILES NC(\C(=N/C1=CC=C(C=C1)N(C)C)OCC)=O
Spectrum/Structure Validation Score (Raman) 0.875121