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Tricyclo[3.2.1.0(3,6)]octan-7-one, 2-(acetyloxy)-2,6-dimethyl-, stereoisomer
SpectraBase Compound ID GRFiv6BQWuM
InChI InChI=1S/C12H16O3/c1-6(13)15-12(3)8-4-7-5-9(12)11(7,2)10(8)14/h7-9H,4-5H2,1-3H3/t7-,8+,9-,11-,12+/m1/s1
InChIKey ZBRJGTTUAILFLG-YYTHCXKUSA-N
Mol Weight 208.26 g/mol
Molecular Formula C12H16O3
Exact Mass 208.109944 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6xdz7GKWMIy
Name Tricyclo[3.2.1.0(3,6)]octan-7-one, 2-(acetyloxy)-2,6-dimethyl-, stereoisomer
Alternate Name(s) 2,6-Dimethyl-7-oxotricyclo[3.2.1.0(3,6)]oct-2-yl acetate exo-2-acetoxy-2,6-dimethyltricyclo[3.2.1.0(3,6)]octan-7-one
CAS Registry Number 64701-33-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H16O3
InChI InChI=1S/C12H16O3/c1-6(13)15-12(3)8-4-7-5-9(12)11(7,2)10(8)14/h7-9H,4-5H2,1-3H3/t7-,8+,9-,11-,12+/m1/s1
InChIKey ZBRJGTTUAILFLG-YYTHCXKUSA-N
Molecular Weight 208.257 g/mol
SMILES [C@]1([C@@]2(C(=O)[C@]3([C@]1(C[C@]3(C2)[H])[H])C)[H])(OC(=O)C)C
SPLASH splash10-052g-8910000000-7c653a2b22b1ed7d1fd4
Source of Spectrum C-99-8018-0
Wiley ID 1206835