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hexahydro-1-methyl-2H-azepin-2-one

View entire compound with spectra: 4 NMR, 3 FTIR, 1 Raman, and 8 MS (GC)

hexahydro-1-methyl-2H-azepin-2-one
SpectraBase Compound ID 3rk7UtL836H
InChI InChI=1S/C7H13NO/c1-8-6-4-2-3-5-7(8)9/h2-6H2,1H3
InChIKey ZWXPDGCFMMFNRW-UHFFFAOYSA-N
Mol Weight 127.19 g/mol
Molecular Formula C7H13NO
Exact Mass 127.099714 g/mol

13C Nuclear Magnetic Resonance (NMR) Spectrum

13C Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID BNs2vhAi9tX
Name N-Methylcaprolactam
Source of Sample Sigma-Aldrich Co. LLC.
Catalog Number 224766
CAS Registry Number 2556-73-2
Copyright Copyright © 2021-2024 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2021 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H13NO
InChI InChI=1S/C7H13NO/c1-8-6-4-2-3-5-7(8)9/h2-6H2,1H3
InChIKey ZWXPDGCFMMFNRW-UHFFFAOYSA-N
Observed nucleus 13C
Purity 99%
Solvent CDCl3
Source of Spectrum Sigma-Aldrich Co. LLC.
Synonyms Hexahydro-1-methyl-2H-azepin-2-one
Wiley ID SIAL_13CNMR_003392