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1-([6-Hydroxymethyl-2-pyridyl]-methyl)-hexahydr0-1,4-diazepin-5-one
SpectraBase Compound ID 6iBoaCPdDn9
InChI InChI=1S/C12H17N3O2/c16-9-11-3-1-2-10(14-11)8-15-6-4-12(17)13-5-7-15/h1-3,16H,4-9H2,(H,13,17)
InChIKey DZEJSXVVTRMKQW-UHFFFAOYSA-N
Mol Weight 235.29 g/mol
Molecular Formula C12H17N3O2
Exact Mass 235.132077 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KjpGWanONEB
Name 1-((6-(Hydroxymethyl)-2-pyridyl)methyl)hexahydro-1,4-diazepin-5-one
Alternate Name(s) 1-{[6-(hydroxymethyl)-2-pyridinyl]methyl}hexahydro-5H-1,4-diazepin-5-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H17N3O2
InChI InChI=1S/C12H17N3O2/c16-9-11-3-1-2-10(14-11)8-15-6-4-12(17)13-5-7-15/h1-3,16H,4-9H2,(H,13,17)
InChIKey DZEJSXVVTRMKQW-UHFFFAOYSA-N
Molecular Weight 235.287 g/mol
SMILES N1CCN(Cc2nc(CO)ccc2)CCC1=O
SPLASH splash10-00di-0900000000-e143024c52d2d8a38739
Source of Spectrum C-106-639-0
Wiley ID 1237049