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3,3a,4,5,6,7-hexahydro-3-phenyl-6,6-dimethyl-5,7-methylene bridge-2,1-benzisoxazole
SpectraBase Compound ID bTVb5nELv5
InChI InChI=1S/C16H19NO/c1-16(2)11-8-12-14(13(16)9-11)17-18-15(12)10-6-4-3-5-7-10/h3-7,11-13,15H,8-9H2,1-2H3
InChIKey XLBBWIVHGLHCPN-UHFFFAOYSA-N
Mol Weight 241.33 g/mol
Molecular Formula C16H19NO
Exact Mass 241.146664 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FdRVKWt6CwD
Name 3,3a,4,5,6,7-hexahydro-3-phenyl-6,6-dimethyl-5,7-methylene bridge-2,1-benzisoxazole
Appearance White crystals
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Formula C16H19NO
InChI InChI=1S/C16H19NO/c1-16(2)11-8-12-14(13(16)9-11)17-18-15(12)10-6-4-3-5-7-10/h3-7,11-13,15H,8-9H2,1-2H3
InChIKey XLBBWIVHGLHCPN-UHFFFAOYSA-N
Ionization Type EI
Molecular Weight 241.334 g/mol
Optical Rotation [a]D28 = -138.0 (c = 0.05, CH3OH)
SMILES C12C=3C(CC(C2(C)C)C1)C(ON3)c1ccccc1
SPLASH splash10-006x-2490000000-61ee05062252d8603098
Source of Spectrum CN103980217B
Wiley ID 1850229