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4-Azatricyclo[4.4.0.0(3,8)]decan-5-one, 10-hydroxy-4-(phenylmethyl)-, stereoisomer
SpectraBase Compound ID AzfkUaXlsFH
InChI InChI=1S/C16H19NO2/c18-15-9-6-12-13-7-8-14(12)17(16(13,15)19)10-11-4-2-1-3-5-11/h1-5,12-14,19H,6-10H2/t12-,13+,14-,16-/m0/s1
InChIKey FVEVRAAMPCHFQO-FQLMCAECSA-N
Mol Weight 257.33 g/mol
Molecular Formula C16H19NO2
Exact Mass 257.141579 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AlfWQv6kDeo
Name 4-Azatricyclo[4.4.0.0(3,8)]decan-5-one, 10-hydroxy-4-(phenylmethyl)-, stereoisomer
Alternate Name(s) 10-Hydroxy-N-benzoyl-4-azatwistane 10-Hydroxy-N-benzyl-4-azatwistan-5-one 7-Benzyl-6-hydroxy-7-azatricyclo[4.4.0.0(2,8)]decan-5-one
CAS Registry Number 89826-07-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H19NO2
InChI InChI=1S/C16H19NO2/c18-15-9-6-12-13-7-8-14(12)17(16(13,15)19)10-11-4-2-1-3-5-11/h1-5,12-14,19H,6-10H2/t12-,13+,14-,16-/m0/s1
InChIKey FVEVRAAMPCHFQO-FQLMCAECSA-N
Molecular Weight 257.333 g/mol
SMILES O[C@]12N([C@]3(CC[C@@]2([C@@]3(CCC1=O)[H])[H])[H])Cc1ccccc1
SPLASH splash10-000f-9720000000-6161f921747c78f168fe
Source of Spectrum F-40-366-0
Wiley ID 1260927