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(5S,7S,8S,11S)-6-Benzylidene-7-hydroxy-9-oxa-1-azatricyclo[6.2.1.0(5,11)]undecan-10-one

View entire compound with spectra: 1 MS (GC)

(5S,7S,8S,11S)-6-Benzylidene-7-hydroxy-9-oxa-1-azatricyclo[6.2.1.0(5,11)]undecan-10-one
SpectraBase Compound ID 5vI3e1BcbeK
InChI InChI=1S/C16H17NO3/c18-14-12(9-10-5-2-1-3-6-10)11-7-4-8-17-13(11)15(14)20-16(17)19/h1-3,5-6,9,11,13-15,18H,4,7-8H2/b12-9-/t11-,13-,14-,15-/m0/s1
InChIKey SZLKJRIZIROMSE-DQWPGTAFSA-N
Mol Weight 271.32 g/mol
Molecular Formula C16H17NO3
Exact Mass 271.120843 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4Ez3jvi4ru1
Name (5S,7S,8S,11S)-6-Benzylidene-7-hydroxy-9-oxa-1-azatricyclo[6.2.1.0(5,11)]undecan-10-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H17NO3
InChI InChI=1S/C16H17NO3/c18-14-12(9-10-5-2-1-3-6-10)11-7-4-8-17-13(11)15(14)20-16(17)19/h1-3,5-6,9,11,13-15,18H,4,7-8H2/b12-9-/t11-,13-,14-,15-/m0/s1
InChIKey SZLKJRIZIROMSE-DQWPGTAFSA-N
Molecular Weight 271.316 g/mol
SMILES O[C@]1(\C(=C/c2ccccc2)[C@]2([C@]3([C@@]1(OC(=O)N3CCC2)[H])[H])[H])[H]
SPLASH splash10-004i-2590000000-478831035956379aa0bd
Source of Spectrum K1-2001-2849-23
Synonyms (2aS,3S,4Z,4aS,7bS)-4-benzylidene-3-hydroxyoctahydro-2-oxa-7a-azacyclopenta[cd]inden-1-one 6-Benzylidene-7-hydroxy-9-oxa-1-azatricyclo[6.2.1.0(5,11)]undecan-1-one 6-Benzylidene-7-hydroxy-9-oxa-1-azatricyclo[6.2.1.0(5,11)]undecan-10-one
Wiley ID 813956