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trans-2,2-Difluoro-3-methylcyclopropanecarboxylic Acid
SpectraBase Compound ID AxndEm2xnQB
InChI InChI=1S/C5H6F2O2/c1-2-3(4(8)9)5(2,6)7/h2-3H,1H3,(H,8,9)/t2-,3+/m1/s1
InChIKey AVEOEYKDGIQSBO-GBXIJSLDSA-N
Mol Weight 136.1 g/mol
Molecular Formula C5H6F2O2
Exact Mass 136.033586 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4wOEBmb8IaB
Name trans-2,2-Difluoro-3-methylcyclopropanecarboxylic Acid
Alternate Name(s) (1S,3R)-2,2-difluoro-3-methylcyclopropane-1-carboxylic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C5H6F2O2
InChI InChI=1S/C5H6F2O2/c1-2-3(4(8)9)5(2,6)7/h2-3H,1H3,(H,8,9)/t2-,3+/m1/s1
InChIKey AVEOEYKDGIQSBO-GBXIJSLDSA-N
Literature Reference DOI 10.1002/adsc.201801006
Molecular Weight 136.098 g/mol
SMILES OC(=O)[C@@]1([C@@](C)(C1(F)F)[H])[H]
SPLASH splash10-0fxx-9200000000-e555cd2b22f63c0330a6
Source of Spectrum ASC-360-4112-10b
Wiley ID 1812203