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(S)-5-(11-hydroxy-6-oxo-6,11-dihydro-5H-dibenzo[b,e]azepin-5-yl)pentanenitrile
SpectraBase Compound ID FdukMUkVfgI
InChI InChI=1S/C19H18N2O2/c20-12-6-1-7-13-21-17-11-5-4-10-16(17)18(22)14-8-2-3-9-15(14)19(21)23/h2-5,8-11,18,22H,1,6-7,13H2/t18-/m0/s1
InChIKey WMSSLWZFUNOGOE-SFHVURJKSA-N
Mol Weight 306.37 g/mol
Molecular Formula C19H18N2O2
Exact Mass 306.136828 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LXpsFJlZxT9
Name (S)-5-(11-hydroxy-6-oxo-6,11-dihydro-5H-dibenzo[b,e]azepin-5-yl)pentanenitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H18N2O2
InChI InChI=1S/C19H18N2O2/c20-12-6-1-7-13-21-17-11-5-4-10-16(17)18(22)14-8-2-3-9-15(14)19(21)23/h2-5,8-11,18,22H,1,6-7,13H2/t18-/m0/s1
InChIKey WMSSLWZFUNOGOE-SFHVURJKSA-N
Literature Reference DOI 10.1039/C6QO00036C
Molecular Weight 306.365 g/mol
SMILES O[C@@]1(c2c(N(CCCCC#N)C(c3c1cccc3)=O)cccc2)[H]
SPLASH splash10-004i-1090000000-bbdef005da8df6a7c1bc
Source of Spectrum OCF-3-614/SM16-8h
Wiley ID 1804838