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1,4-Diazacyclododecan-5-one, 1-acetyl-

View entire compound with spectra: 1 NMR, 1 FTIR, and 1 MS (GC)

1,4-Diazacyclododecan-5-one, 1-acetyl-
SpectraBase Compound ID KFvsqKK5FXt
InChI InChI=1S/C12H22N2O2/c1-11(15)14-9-6-4-2-3-5-7-12(16)13-8-10-14/h2-10H2,1H3,(H,13,16)
InChIKey BFZFKIWYLIZHSU-UHFFFAOYSA-N
Mol Weight 226.32 g/mol
Molecular Formula C12H22N2O2
Exact Mass 226.168128 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 9YK6ldKYHE6
Name 1,4-Diazacyclododecan-5-one, 1-acetyl-
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 226.168127954 u
Formula C12H22N2O2
InChI InChI=1S/C12H22N2O2/c1-11(15)14-9-6-4-2-3-5-7-12(16)13-8-10-14/h2-10H2,1H3,(H,13,16)
InChIKey BFZFKIWYLIZHSU-UHFFFAOYSA-N
Molecular Weight 226.320 g/mol
SMILES C(N1CCNC(=O)CCCCCCC1)(=O)C
Spectrum/Structure Validation Score (Vapor Phase IR) 0.85833