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2-Oxo-3-isopropyl-4-methyl-5,6-benzo-1-oxa-4-azacycloheptane
SpectraBase Compound ID I4jtQkgXjJu
InChI InChI=1S/C13H17NO2/c1-9(2)12-13(15)16-8-10-6-4-5-7-11(10)14(12)3/h4-7,9,12H,8H2,1-3H3/t12-/m0/s1
InChIKey BUSDMILLODVAJR-LBPRGKRZSA-N
Mol Weight 219.28 g/mol
Molecular Formula C13H17NO2
Exact Mass 219.125929 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID vWzAdmkb87
Name 2-Oxo-3-isopropyl-4-methyl-5,6-benzo-1-oxa-4-azacycloheptane
Alternate Name(s) (2S)-1-methyl-2-propan-2-yl-2,5-dihydro-4,1-benzoxazepin-3-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H17NO2
InChI InChI=1S/C13H17NO2/c1-9(2)12-13(15)16-8-10-6-4-5-7-11(10)14(12)3/h4-7,9,12H,8H2,1-3H3/t12-/m0/s1
InChIKey BUSDMILLODVAJR-LBPRGKRZSA-N
Molecular Weight 219.284 g/mol
SMILES [C@@]1(N(c2c(COC1=O)cccc2)C)(C(C)C)[H]
SPLASH splash10-00kf-8950000000-65a014f2936c3c44d724
Source of Spectrum C-120-12465-27
Wiley ID 1699948