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6-exo-(1-Methylethoxy)-9-(4-fluorobenzyl)-5-oxa-9-azatricyclo[5.2.1.0(4,8)]decan-2-one

View entire compound with spectra: 1 MS (GC)

6-exo-(1-Methylethoxy)-9-(4-fluorobenzyl)-5-oxa-9-azatricyclo[5.2.1.0(4,8)]decan-2-one
SpectraBase Compound ID 8DJ3xtugXAI
InChI InChI=1S/C18H22FNO3/c1-10(2)22-18-13-7-14-15(21)8-16(23-18)17(13)20(14)9-11-3-5-12(19)6-4-11/h3-6,10,13-14,16-18H,7-9H2,1-2H3/t13-,14-,16+,17+,18-/m0/s1
InChIKey ZIVZHOCJCIVJIY-TVNOUSRMSA-N
Mol Weight 319.38 g/mol
Molecular Formula C18H22FNO3
Exact Mass 319.158372 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 62XaJycUWgv
Name 6-exo-(1-Methylethoxy)-9-(4-fluorobenzyl)-5-oxa-9-azatricyclo[5.2.1.0(4,8)]decan-2-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H22FNO3
InChI InChI=1S/C18H22FNO3/c1-10(2)22-18-13-7-14-15(21)8-16(23-18)17(13)20(14)9-11-3-5-12(19)6-4-11/h3-6,10,13-14,16-18H,7-9H2,1-2H3/t13-,14-,16+,17+,18-/m0/s1
InChIKey ZIVZHOCJCIVJIY-TVNOUSRMSA-N
Molecular Weight 319.376 g/mol
SMILES [C@@]12(N([C@@]3(C(C[C@]1(O[C@@]([C@]2(C3)[H])(OC(C)C)[H])[H])=O)[H])Cc1ccc(cc1)F)[H]
SPLASH splash10-0a4i-0920000000-2898b1497be2c6a0534c
Source of Spectrum H1-50-944-4
Synonyms 9-(4-fluorobenzyl)-6-isopropoxy-5-oxa-9-azatricyclo[5.2.1.0(4,8)]decan-2-one
Wiley ID 816850