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(1S*,2S*,6R*,7R*)-1,11,11-Trimethyl-10-oxotricyclo[5.2.2.0(2,6)]undeca-3,8-dien-8-yltrifluoromethanesulfonate
SpectraBase Compound ID EfkmJIK3zE3
InChI InChI=1S/C15H17F3O4S/c1-13(2)11-8-5-4-6-9(8)14(3,12(13)19)7-10(11)22-23(20,21)15(16,17)18/h4,6-9,11H,5H2,1-3H3/t8-,9+,11+,14+/m1/s1
InChIKey IORFMNFUEJXLSD-DKZXUEBISA-N
Mol Weight 350.35 g/mol
Molecular Formula C15H17F3O4S
Exact Mass 350.079965 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID QiczfgrCa
Name (1S*,2S*,6R*,7R*)-1,11,11-Trimethyl-10-oxotricyclo[5.2.2.0(2,6)]undeca-3,8-dien-8-yltrifluoromethanesulfonate
Alternate Name(s) 1,11,11-trimethyl-10-oxotricyclo[5.2.2.0(2,6)]undeca-3,8-dien-8-yl trifluoromethanesulfonate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H17F3O4S
InChI InChI=1S/C15H17F3O4S/c1-13(2)11-8-5-4-6-9(8)14(3,12(13)19)7-10(11)22-23(20,21)15(16,17)18/h4,6-9,11H,5H2,1-3H3/t8-,9+,11+,14+/m1/s1
InChIKey IORFMNFUEJXLSD-DKZXUEBISA-N
Molecular Weight 350.352 g/mol
SMILES C(S(OC=1[C@]2(C(C)(C)C([C@@](C1)([C@]1(C=CC[C@@]21[H])[H])C)=O)[H])(=O)=O)(F)(F)F
SPLASH splash10-014r-9271000000-162a158c3355c9402f7c
Source of Spectrum F-69-456-15
Wiley ID 1594543