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(1R,7R,8R)-3-(4-chlorophenyl)-7,9,9-trimethyl-4-oxa-5-azatricyclo[6.1.1.0(2,6)]dec-5-en-7-ol
SpectraBase Compound ID 1zeHtLEG3X3
InChI InChI=1S/C17H20ClNO2/c1-16(2)11-8-12(16)17(3,20)15-13(11)14(21-19-15)9-4-6-10(18)7-5-9/h4-7,11-14,20H,8H2,1-3H3/t11-,12-,13?,14?,17-/m1/s1
InChIKey DYBXDUFOGLWNLP-AWWODCARSA-N
Mol Weight 305.81 g/mol
Molecular Formula C17H20ClNO2
Exact Mass 305.118257 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID G9F4T9dhmiX
Name (1R,7R,8R)-3-(4-chlorophenyl)-7,9,9-trimethyl-4-oxa-5-azatricyclo[6.1.1.0(2,6)]dec-5-en-7-ol
Appearance White needle crystals
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H20ClNO2
InChI InChI=1S/C17H20ClNO2/c1-16(2)11-8-12(16)17(3,20)15-13(11)14(21-19-15)9-4-6-10(18)7-5-9/h4-7,11-14,20H,8H2,1-3H3/t11-,12-,13?,14?,17-/m1/s1
InChIKey DYBXDUFOGLWNLP-AWWODCARSA-N
Instrument Name Agilent 5975C
Ionization Type EI
Molecular Weight 305.805 g/mol
Optical Rotation [a]D20 = -23.8 (c = 0.5, CH3OH)
SMILES O[C@]1(C)[C@]2(C([C@@](C3C1=NOC3c1ccc(cc1)Cl)(C2)[H])(C)C)[H]
SPLASH splash10-000l-9880000000-26d9af2052d8e244d712
Source of Spectrum CN103319430A
Wiley ID 1847488