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(+)-(1S,7S,11S,2R,10R13R)-1,5,11-Trimethyltetracyclo[8.5.0.0(2,7).0(11,13)]pentadeca-5-en-6-yl trifluoromethanesulfonate

View entire compound with spectra: 1 MS (GC)

(+)-(1S,7S,11S,2R,10R13R)-1,5,11-Trimethyltetracyclo[8.5.0.0(2,7).0(11,13)]pentadeca-5-en-6-yl trifluoromethanesulfonate
SpectraBase Compound ID 9rJDBU3kuFp
InChI InChI=1S/C19H27F3O3S/c1-11-4-6-14-13(16(11)25-26(23,24)19(20,21)22)5-7-15-17(14,2)9-8-12-10-18(12,15)3/h12-15H,4-10H2,1-3H3/t12-,13+,14-,15+,17+,18+/m1/s1
InChIKey QYJYFDHLHHRTPY-IAUIDUKPSA-N
Mol Weight 392.48 g/mol
Molecular Formula C19H27F3O3S
Exact Mass 392.1633 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3gafNUuLXfQ
Name (+)-(1S,7S,11S,2R,10R13R)-1,5,11-Trimethyltetracyclo[8.5.0.0(2,7).0(11,13)]pentadeca-5-en-6-yl trifluoromethanesulfonate
Alternate Name(s) (1aS,1bR,3aS,7aR,7bS,9aR)-1a,5,7b-trimethyl-1a,1b,2,3,3a,6,7,7a,7b,8,9,9a-dodecahydro-1H-cyclopropa[a]phenanthren-4-yl trifluoromethanesulfonate Trifluoromethanesulfonic acid[(1aS,1bR,3aS,7aR,7bS,9aR)-1a,5,7b-trimethyl-1b,2,3,3a,6,7,7a,8,9,9a-decahydro-1H-cyclopropa[a]phenanthren-4-yl]ester [(1aS,1bR,3aS,7aR,7bS,9aR)-1a,5,7b-trimethyl-1b,2,3,3a,6,7,7a,8,9,9a-decahydro-1H-cyclopropa[a]phenanthren-4-yl]trifluoromethanesulfonate [(1aS,1bR,3aS,7aR,7bS,9aR)-1a,5,7b-trimethyl-1b,2,3,3a,6,7,7a,8,9,9a-decahydro-1H-cyclopropa[a]phenanthren-4-yl]tris(fluoranyl)methanesulfonate [(1aS,1bR,3aS,7aR,7bS,9aR)-1a,5,7b-trimethyl-1b,2,3,3a,6,7,7a,8,9,9a-decahydro-1H-cyclopropa[a]phenanthren-4-yl] trifluoromethanesulfonate [(1aS,1bR,3aS,7aR,7bS,9aR)-1a,5,7b-trimethyl-1b,2,3,3a,6,7,7a,8,9,9a-decahydro-1H-cyclopropa[a]phenanthren-4-yl] tris(fluoranyl)methanesulfonate
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Formula C19H27F3O3S
InChI InChI=1S/C19H27F3O3S/c1-11-4-6-14-13(16(11)25-26(23,24)19(20,21)22)5-7-15-17(14,2)9-8-12-10-18(12,15)3/h12-15H,4-10H2,1-3H3/t12-,13+,14-,15+,17+,18+/m1/s1
InChIKey QYJYFDHLHHRTPY-IAUIDUKPSA-N
Molecular Weight 392.477 g/mol
SMILES C=1(OS(C(F)(F)F)(=O)=O)[C@@]2([C@@]([C@@]3(CC[C@]4([C@@]([C@]3(CC2)[H])(C4)C)[H])C)([H])CCC1C)[H]
SPLASH splash10-0zic-0539000000-1a4fc3fd49e971bc51bd
Source of Spectrum KC-0-1840-16
Wiley ID 822631