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(1R,3S)-3-(Methoxycarbonyl)-2,2-dimethylcyclopropane-1-carboxylic Acid
SpectraBase Compound ID IFe8ByortNt
InChI InChI=1S/C8H12O4/c1-8(2)4(6(9)10)5(8)7(11)12-3/h4-5H,1-3H3,(H,9,10)/t4-,5+/m0/s1
InChIKey LNIQYJXNDLAPKL-CRCLSJGQSA-N
Mol Weight 172.18 g/mol
Molecular Formula C8H12O4
Exact Mass 172.073559 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID UhkOVFUP2
Name (1R,3S)-3-(Methoxycarbonyl)-2,2-dimethylcyclopropane-1-carboxylic Acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H12O4
InChI InChI=1S/C8H12O4/c1-8(2)4(6(9)10)5(8)7(11)12-3/h4-5H,1-3H3,(H,9,10)/t4-,5+/m0/s1
InChIKey LNIQYJXNDLAPKL-CRCLSJGQSA-N
Literature Reference DOI 10.1002/hlca.19910740832
Molecular Weight 172.180 g/mol
SMILES OC([C@@]1([C@](C(=O)OC)(C1(C)C)[H])[H])=O
SPLASH splash10-07dp-9500000000-5e518ecc7132b95488b9
Source of Spectrum H-74-1950-2b
Wiley ID 1789380