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(4a,4aa,8aa,9a)-2,2-Bis(methoxycarbonyl)-4,9-bis(3,4,5-trifluorophenyl)-1,3,4,4a,5,8,8a,9-octahydro-5,8-methanocyclopenta[b]naphthalene

View entire compound with spectra: 1 MS (GC)

(4a,4aa,8aa,9a)-2,2-Bis(methoxycarbonyl)-4,9-bis(3,4,5-trifluorophenyl)-1,3,4,4a,5,8,8a,9-octahydro-5,8-methanocyclopenta[b]naphthalene
SpectraBase Compound ID A7iaCZwav6m
InChI InChI=1S/C30H24F6O4/c1-39-28(37)30(29(38)40-2)10-16-17(11-30)23(15-8-20(33)27(36)21(34)9-15)25-13-4-3-12(5-13)24(25)22(16)14-6-18(31)26(35)19(32)7-14/h3-4,6-9,12-13,22-25H,5,10-11H2,1-2H3/t12?,13?,22-,23+,24+,25-
InChIKey PNOWPRYLQFBUDA-QSORCKBASA-N
Mol Weight 562.51 g/mol
Molecular Formula C30H24F6O4
Exact Mass 562.157878 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Ds0cZz2FrPZ
Name (4a,4aa,8aa,9a)-2,2-Bis(methoxycarbonyl)-4,9-bis(3,4,5-trifluorophenyl)-1,3,4,4a,5,8,8a,9-octahydro-5,8-methanocyclopenta[b]naphthalene
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C30H24F6O4
InChI InChI=1S/C30H24F6O4/c1-39-28(37)30(29(38)40-2)10-16-17(11-30)23(15-8-20(33)27(36)21(34)9-15)25-13-4-3-12(5-13)24(25)22(16)14-6-18(31)26(35)19(32)7-14/h3-4,6-9,12-13,22-25H,5,10-11H2,1-2H3/t12?,13?,22-,23+,24+,25-
InChIKey PNOWPRYLQFBUDA-QSORCKBASA-N
Molecular Weight 562.508 g/mol
SMILES C1(CC=2[C@@]([C@]3(C4C=CC([C@]3([C@@](C2C1)(c1cc(F)c(c(c1)F)F)[H])[H])C4)[H])(c1cc(F)c(c(c1)F)F)[H])(C(=O)OC)C(=O)OC
SPLASH splash10-016s-7916200000-d61f95c6afcb695a024e
Source of Spectrum U1-2010-677-11e
Wiley ID 1663351