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Methanesulfonic acid, trifluoro-,2-(2,2-dimethylpropyl)-3,8-dimethyl-4-oxo-1-oxaspiro[4.4]nona-2,6-dien-6-yl ester, (5R,trans)-
SpectraBase Compound ID 5dQlqK1dwRQ
InChI InChI=1S/C16H21F3O5S/c1-9-6-12(24-25(21,22)16(17,18)19)15(7-9)13(20)10(2)11(23-15)8-14(3,4)5/h6,9H,7-8H2,1-5H3/t9-,15+/m0/s1
InChIKey JJIOFDKMCJTSIY-BJOHPYRUSA-N
Mol Weight 382.39 g/mol
Molecular Formula C16H21F3O5S
Exact Mass 382.106179 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HBxJIU6sNnZ
Name Methanesulfonic acid, trifluoro-,2-(2,2-dimethylpropyl)-3,8-dimethyl-4-oxo-1-oxaspiro[4.4]nona-2,6-dien-6-yl ester, (5R,trans)-
Alternate Name(s) (5R,8R)-3,8-dimethyl-2-neopentyl-4-oxo-1-oxaspiro[4.4]nona-2,6-dien-6-yl trifluoromethanesulfonate
CAS Registry Number 142843-51-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H21F3O5S
InChI InChI=1S/C16H21F3O5S/c1-9-6-12(24-25(21,22)16(17,18)19)15(7-9)13(20)10(2)11(23-15)8-14(3,4)5/h6,9H,7-8H2,1-5H3/t9-,15+/m0/s1
InChIKey JJIOFDKMCJTSIY-BJOHPYRUSA-N
Molecular Weight 382.394 g/mol
SMILES [C@@]12(C(OS(C(F)(F)F)(=O)=O)=C[C@@](C2)(C)[H])OC(CC(C)(C)C)=C(C1=O)C
SPLASH splash10-0aou-9410000000-ea501ef850a6ea04067c
Source of Spectrum C-114-7695-12
Wiley ID 1360378