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(5R*,7S*)-5-methyl-7-p-nitrophenyl-8-oxa-1-azabicyclo[3.2.1]octane
SpectraBase Compound ID L05yH1Umilp
InChI InChI=1S/C13H16N2O3/c1-13-7-2-8-14(18-13)12(9-13)10-3-5-11(6-4-10)15(16)17/h3-6,12H,2,7-9H2,1H3/t12-,13+/m0/s1
InChIKey NGXDUJNASZFQAC-QWHCGFSZSA-N
Mol Weight 248.28 g/mol
Molecular Formula C13H16N2O3
Exact Mass 248.116092 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID P26HQK2VBS
Name (5R*,7S*)-5-methyl-7-p-nitrophenyl-8-oxa-1-azabicyclo[3.2.1]octane
Alternate Name(s) (5R,7S)-5-methyl-7-(4-nitrophenyl)-8-oxa-1-azabicyclo[3.2.1]octane
CAS Registry Number 103723-17-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H16N2O3
InChI InChI=1S/C13H16N2O3/c1-13-7-2-8-14(18-13)12(9-13)10-3-5-11(6-4-10)15(16)17/h3-6,12H,2,7-9H2,1H3/t12-,13+/m0/s1
InChIKey NGXDUJNASZFQAC-QWHCGFSZSA-N
Molecular Weight 248.282 g/mol
SMILES [C@]12(ON([C@@](C2)(c2ccc(N(=O)=O)cc2)[H])CCC1)C
SPLASH splash10-01ot-8590000000-d260eed788244b1426bf
Source of Spectrum F-41-3508-77
Wiley ID 1250940