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Tricyclo[3.3.1.1(3,7)]decane-2-carboxylic acid, 4-amino-, ethyl ester, (1.alpha.,2.alpha.,3.beta.,4.alpha.,5.alpha.,7.beta.)-
SpectraBase Compound ID EyOuw6sC8lq
InChI InChI=1S/C13H21NO2/c1-2-16-13(15)11-8-3-7-4-9(6-8)12(14)10(11)5-7/h7-12H,2-6,14H2,1H3/t7-,8+,9-,10+,11-,12+/m1/s1
InChIKey XFUXYIPMHDVZFZ-OWSRUXPGSA-N
Mol Weight 223.32 g/mol
Molecular Formula C13H21NO2
Exact Mass 223.157229 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Kn5bbbVAteM
Name Tricyclo[3.3.1.1(3,7)]decane-2-carboxylic acid, 4-amino-, ethyl ester, (1.alpha.,2.alpha.,3.beta.,4.alpha.,5.alpha.,7.beta.)-
CAS Registry Number 81601-65-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H21NO2
InChI InChI=1S/C13H21NO2/c1-2-16-13(15)11-8-3-7-4-9(6-8)12(14)10(11)5-7/h7-12H,2-6,14H2,1H3/t7-,8+,9-,10+,11-,12+/m1/s1
InChIKey XFUXYIPMHDVZFZ-OWSRUXPGSA-N
Molecular Weight 223.316 g/mol
SMILES N[C@]1([C@]2(C[C@]3([C@]([C@@]1(C[C@](C3)(C2)[H])[H])(C(=O)OCC)[H])[H])[H])[H]
SPLASH splash10-0006-2900000000-0c6bf36be380efeae076
Source of Spectrum KC-1982-77-0
Synonyms Ethyl (1R,2R,3S,4S,5R,7R)-4-aminotricyclo[3.3.1.1(3,7)]decane-2-carboxylate Ethyl ester of 4ax-aminoadamantane-2ax-carboxylic acid
Wiley ID 1224076