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4,5,6,7-Tetrahydro-3-(4'-hydroxyphenyl)-6,6-dimethyl-5,7-methylene bridge-2,1-benzisoxazole
SpectraBase Compound ID 9ukp2wMU0I4
InChI InChI=1S/C16H17NO2/c1-16(2)10-7-12-14(13(16)8-10)17-19-15(12)9-3-5-11(18)6-4-9/h3-6,10,13,18H,7-8H2,1-2H3
InChIKey RISHMWYINOCKPA-UHFFFAOYSA-N
Mol Weight 255.32 g/mol
Molecular Formula C16H17NO2
Exact Mass 255.125929 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JsMyg4MyEc7
Name 4,5,6,7-Tetrahydro-3-(4'-hydroxyphenyl)-6,6-dimethyl-5,7-methylene bridge-2,1-benzisoxazole
Appearance White crystals
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Formula C16H17NO2
InChI InChI=1S/C16H17NO2/c1-16(2)10-7-12-14(13(16)8-10)17-19-15(12)9-3-5-11(18)6-4-9/h3-6,10,13,18H,7-8H2,1-2H3
InChIKey RISHMWYINOCKPA-UHFFFAOYSA-N
Ionization Type EI
Molecular Weight 255.317 g/mol
Optical Rotation [a]D28 = -58.0 (c = 0.05, CH3OH)
SMILES Oc1ccc(-c2c3c(C4C(C(C3)C4)(C)C)no2)cc1
SPLASH splash10-00di-5970000000-de7b18923baaf82adfb3
Source of Spectrum CN103980217B
Wiley ID 1850236