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Dimethyl 2,2,4-(exo),5-(endo)-tetrafluorobicyclo[1.1.1]pentane-1,3-dicarboxylate

View entire compound with spectra: 2 MS (GC)

Dimethyl 2,2,4-(exo),5-(endo)-tetrafluorobicyclo[1.1.1]pentane-1,3-dicarboxylate
SpectraBase Compound ID 7KJAmLqBzHK
InChI InChI=1S/C9H8F4O4/c1-16-5(14)7-3(10)8(4(7)11,6(15)17-2)9(7,12)13/h3-4H,1-2H3/t3-,4?,7-,8+
InChIKey BMMJANWMLBRWMB-OGKKHEHVSA-N
Mol Weight 256.15 g/mol
Molecular Formula C9H8F4O4
Exact Mass 256.035871 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AwG2IDfcPwM
Name Dimethyl 2,2,4-(exo),5-(endo)-tetrafluorobicyclo[1.1.1]pentane-1,3-dicarboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H8F4O4
InChI InChI=1S/C9H8F4O4/c1-16-5(14)7-3(10)8(4(7)11,6(15)17-2)9(7,12)13/h3-4H,1-2H3/t3-,4?,7-,8+
InChIKey BMMJANWMLBRWMB-OGKKHEHVSA-N
Molecular Weight 256.153 g/mol
SMILES [C@]12(C(F)(F)[C@@](C2F)(C(=O)OC)[C@@]1(F)[H])C(=O)OC
SPLASH splash10-0udj-2900000000-233d0bf89b4ab2d3f623
Source of Spectrum C-123-3492-4a
Synonyms Dimethyl 2,2,4-(endo),5-(endo)-tetrafluorobicyclo[1.1.1]pentane-1,3-dicarboxylate
Wiley ID 1700632