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1-chloranylcyclopropane-1-carboxylic acid
SpectraBase Compound ID K1tHJ2f3Rk3
InChI InChI=1S/C4H5ClO2/c5-4(1-2-4)3(6)7/h1-2H2,(H,6,7)
InChIKey RSSNICRIXPNUQK-UHFFFAOYSA-N
Mol Weight 120.53 g/mol
Molecular Formula C4H5ClO2
Exact Mass 119.997807 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Iq6S5rCJQBl
Name 1-chloranylcyclopropane-1-carboxylic acid
Alternate Name(s) 1-chloro-1-cyclopropanecarboxylic acid 1-chlorocyclopropane-1-carboxylic acid 1-chlorocyclopropanecarboxylic acid
CAS Registry Number 108817-35-2
Comments Less than 3 mono-isotopic peaks
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Formula C4H5ClO2
InChI InChI=1S/C4H5ClO2/c5-4(1-2-4)3(6)7/h1-2H2,(H,6,7)
InChIKey RSSNICRIXPNUQK-UHFFFAOYSA-N
Molecular Weight 120.535 g/mol
SMILES OC(C1(CC1)Cl)=O
SPLASH splash10-0079-8900000000-d596c670830a6d35c200
Source of Spectrum C-109-4960-0
Wiley ID 1126984