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(1S,3R,4R)-2-[(S)-1-Phenylethylamino]-2-azabicyclo[2.2.1]hept-5-ene-3-methylketone
SpectraBase Compound ID EiBl6x8NXcz
InChI InChI=1S/C16H19NO/c1-11(13-6-4-3-5-7-13)17-15-9-8-14(10-15)16(17)12(2)18/h3-9,11,14-16H,10H2,1-2H3/t11-,14+,15+,16-/m0/s1
InChIKey JCQFBFRXPRDHPD-SRMUXQRQSA-N
Mol Weight 241.33 g/mol
Molecular Formula C16H19NO
Exact Mass 241.146664 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID YcLzI8sDHl
Name (1S,3R,4R)-2-[(S)-1-Phenylethylamino]-2-azabicyclo[2.2.1]hept-5-ene-3-methylketone
Alternate Name(s) 1-(2-Isopropyl-2-aza-bicyclo[2.2.1]hept-5-en-3-yl)-ethanone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H19NO
InChI InChI=1S/C16H19NO/c1-11(13-6-4-3-5-7-13)17-15-9-8-14(10-15)16(17)12(2)18/h3-9,11,14-16H,10H2,1-2H3/t11-,14+,15+,16-/m0/s1
InChIKey JCQFBFRXPRDHPD-SRMUXQRQSA-N
Molecular Weight 241.334 g/mol
SMILES [C@@]12(N([C@]([C@@](C=C2)([H])C1)(C(=O)C)[H])[C@](c1ccccc1)(C)[H])[H]
SPLASH splash10-052b-0900000000-a3a626b07d275d05c70a
Source of Spectrum QE-5-1697-16b
Wiley ID 844213