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(2S,4aS,8aS)-2-(4-chlorophenyl)octahydro-1H-benzo[d][1,3]oxazine
SpectraBase Compound ID LIMZ1tNy00M
InChI InChI=1S/C14H18ClNO/c15-12-7-5-10(6-8-12)14-16-13-4-2-1-3-11(13)9-17-14/h5-8,11,13-14,16H,1-4,9H2/t11-,13+,14+/m1/s1
InChIKey QEFXUPWCEBFGSC-XBFCOCLRSA-N
Mol Weight 251.76 g/mol
Molecular Formula C14H18ClNO
Exact Mass 251.107692 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 88onczE7gQa
Name (2S,4aS,8aS)-2-(4-chlorophenyl)octahydro-1H-benzo[d][1,3]oxazine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H18ClNO
InChI InChI=1S/C14H18ClNO/c15-12-7-5-10(6-8-12)14-16-13-4-2-1-3-11(13)9-17-14/h5-8,11,13-14,16H,1-4,9H2/t11-,13+,14+/m1/s1
InChIKey QEFXUPWCEBFGSC-XBFCOCLRSA-N
Instrument Name Jeol JMS D300
Ionization Type EI
Literature Reference DOI 10.1002/rcm.1290070613
Molecular Weight 251.757 g/mol
SMILES N1[C@@](OC[C@@]2([C@@]1(CCCC2)[H])[H])(c1ccc(cc1)Cl)[H]
SPLASH splash10-0006-1950000000-32a99e4318c00473b812
Source of Spectrum RCM-7-468-4c
Wiley ID 1838851