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(1S,2R,5R,6S,7S)-1,5-Dimethyl-6-(2-methoxyphenyl)tricyclo[3.2.1.0(2,7)]octan-4-one
SpectraBase Compound ID 3UhcQe5Q8Ur
InChI InChI=1S/C17H20O2/c1-16-9-17(2)13(18)8-11(16)15(16)14(17)10-6-4-5-7-12(10)19-3/h4-7,11,14-15H,8-9H2,1-3H3/t11-,14-,15+,16+,17+/m1/s1
InChIKey IQGZVDFWMHGTTP-AXMLXZGRSA-N
Mol Weight 256.34 g/mol
Molecular Formula C17H20O2
Exact Mass 256.14633 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Eoxm10LDyk4
Name (1S,2R,5R,6S,7S)-1,5-Dimethyl-6-(2-methoxyphenyl)tricyclo[3.2.1.0(2,7)]octan-4-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H20O2
InChI InChI=1S/C17H20O2/c1-16-9-17(2)13(18)8-11(16)15(16)14(17)10-6-4-5-7-12(10)19-3/h4-7,11,14-15H,8-9H2,1-3H3/t11-,14-,15+,16+,17+/m1/s1
InChIKey IQGZVDFWMHGTTP-AXMLXZGRSA-N
Molecular Weight 256.345 g/mol
SMILES [C@@]12([C@@]3([C@](c4c(OC)cccc4)([H])[C@@](C1)(C(=O)C[C@@]23[H])C)[H])C
SPLASH splash10-0a4i-0390000000-3df7c1e094d92e85bb26
Source of Spectrum KC-0-180-15
Synonyms (1R,5R,6S,7S)-6-(2-methoxyphenyl)-1,5-dimethyltricyclo[3.2.1.0(2,7)]octan-4-one (1S,2S,5S,6R/S,7S)-1,5-Dimethyl-6-(2-methoxyphenyl)tricyclo[3.2.1.0(2,7)]octan-4-one
Wiley ID 787124