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E-Caprolactam

View entire compound with spectra: 85 NMR, 13 FTIR, 2 Raman, and 20 MS (GC)

E-Caprolactam
SpectraBase Compound ID 9A4DhXH6ISU
InChI InChI=1S/C6H11NO/c8-6-4-2-1-3-5-7-6/h1-5H2,(H,7,8)
InChIKey JBKVHLHDHHXQEQ-UHFFFAOYSA-N
Mol Weight 113.16 g/mol
Molecular Formula C6H11NO
Exact Mass 113.084064 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1rmx1aQHNpg
Name HEXAHYDRO-2H-AZEPIN-2-ONE
Source of Sample Tokyo Kasei Kogyo Company, Ltd., Tokyo, Japan
CAS Registry Number 105-60-2
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C6H11NO
InChI InChI=1S/C6H11NO/c8-6-4-2-1-3-5-7-6/h1-5H2,(H,7,8)
InChIKey JBKVHLHDHHXQEQ-UHFFFAOYSA-N
Melting Point 70C
Molecular Weight 113.16
Solvent Chloroform-d; Reference=TMS Spectrometer= Bruker AC-300
Synonyms CAPROLACTAM 2H-AZEPIN-2-ONE, HEXAHYDRO-,
Web Link http://www.cdc.gov/niosh/npg/npgd0097.html