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(+)-ethyl 2-[(6R)-6-azido-4-benzyl-1,4-diazepan-1-yl]acetate
SpectraBase Compound ID JHvenoVlWMu
InChI InChI=1S/C16H23N5O2/c1-2-23-16(22)13-21-9-8-20(11-15(12-21)18-19-17)10-14-6-4-3-5-7-14/h3-7,15H,2,8-13H2,1H3/t15-/m1/s1
InChIKey XQDFQOBUXMCBOU-OAHLLOKOSA-N
Mol Weight 317.39 g/mol
Molecular Formula C16H23N5O2
Exact Mass 317.185175 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AdMcPnoiHH
Name (+)-ethyl 2-[(6R)-6-azido-4-benzyl-1,4-diazepan-1-yl]acetate
Alternate Name(s) (R)-ethyl 2-(6-azido-4-benzyl-1,4-diazepan-1-yl)acetate 2-[(6R)-6-azido-4-(phenylmethyl)-1,4-diazepan-1-yl]acetic acid ethyl ester Ethyl 2-[(6R)-6-azido-4-benzyl-1,4-diazepan-1-yl]acetate Ethyl 2-[(6R)-6-azido-4-(phenylmethyl)-1,4-diazepan-1-yl]ethanoate
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Formula C16H23N5O2
InChI InChI=1S/C16H23N5O2/c1-2-23-16(22)13-21-9-8-20(11-15(12-21)18-19-17)10-14-6-4-3-5-7-14/h3-7,15H,2,8-13H2,1H3/t15-/m1/s1
InChIKey XQDFQOBUXMCBOU-OAHLLOKOSA-N
Molecular Weight 317.393 g/mol
SMILES [C@]1(N=[N+]=[N-])(CN(Cc2ccccc2)CCN(C1)CC(=O)OCC)[H]
SPLASH splash10-002f-7290000000-008470b3431692a396aa
Source of Spectrum F-41-392-9b
Wiley ID 1735003