N-Methylcaprolactam

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Systematic / IUPAC Name: 1-Methyl-2-azepanone

ID: Reference1415

Other Names: 1-Methylazepan-2-one;
N-Methyl-ε-caprolactam;
ε-Caprolactam, N-methyl-;
Hexahydro-N-methyl-2H-azepin-2-one;
1-Methylazaperhydroepin-2-one

Formula: C7H13NO

Spectral Data

N-Methylcaprolactam mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.

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Available MS Data

Used Instruments Q Exactive Orbitrap
No. of Spectral Trees 1
No. of Spectra 71
Tandem Spectra MS1, MS2
Ionization Methods ESI
Analyzers FT
Last Modification 12/3/2014 2:37:48 PM
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Identificators

InChI InChI=1S/C7H13NO/c1-8-6-4-2-3-5-7(8)9/h2-6H2,1H3
InChI Key ZWXPDGCFMMFNRW-UHFFFAOYSA-N
Canonical SMILES CN1CCCCCC1=O
CAS 2556732
Splash
Other Names 1-Methylazepan-2-one;
N-Methyl-ε-caprolactam;
ε-Caprolactam, N-methyl-;
Hexahydro-N-methyl-2H-azepin-2-one;
1-Methylazaperhydroepin-2-one;
Hexahydro-1-methyl-2H-azepin-2-one

In Other Databases

ChEMBL CHEMBL12103
ChemSpider 16434
ChemIDPlus 002556732
PubChem 17369