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CIS-2-AMINOCYCLOHEX-3-ENE-1-CARBOXYLIC-ACID

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CIS-2-AMINOCYCLOHEX-3-ENE-1-CARBOXYLIC-ACID
SpectraBase Compound ID B6GIdCLCCa8
InChI InChI=1S/C7H11NO2/c8-6-4-2-1-3-5(6)7(9)10/h2,4-6H,1,3,8H2,(H,9,10)/t5-,6+/m0/s1
InChIKey CIXNUOPCFXQTTK-NTSWFWBYSA-N
Mol Weight 141.17 g/mol
Molecular Formula C7H11NO2
Exact Mass 141.078979 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7AI4UHGcy9p
Name CIS-2-AMINOCYCLOHEX-3-ENE-1-CARBOXYLIC-ACID
Compound Number 5
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C7H11NO2
InChI InChI=1S/C7H11NO2/c8-6-4-2-1-3-5(6)7(9)10/h2,4-6H,1,3,8H2,(H,9,10)/t5-,6+/m0/s1
InChIKey CIXNUOPCFXQTTK-NTSWFWBYSA-N
Literature Reference Author S.CHOI,R.B.SILVERMAN
Literature Reference Citation J.MED.CHEM.,45,4531(2002)
Literature Reference DOI 10.1021/jm020134i
Molecular Weight 141.170 g/mol
Sample ID 65109
Solvent D2O