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3-Amino-5,7-dimethyl-1-adamantanecarboxylic acid
SpectraBase Compound ID Anhbd5gpNkp
InChI InChI=1S/C13H21NO2/c1-10-3-11(2)5-12(4-10,9(15)16)8-13(14,6-10)7-11/h3-8,14H2,1-2H3,(H,15,16)/t10-,11+,12+,13-
InChIKey VGTIAGCVYBEACG-FNFFVJSTSA-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 9VsjNXP31A8
Name 3-Amino-5,7-dimethyl-1-adamantanecarboxylic acid
CAS Registry Number 14664-67-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H21NO2
InChI InChI=1S/C13H21NO2/c1-10-3-11(2)5-12(4-10,9(15)16)8-13(14,6-10)7-11/h3-8,14H2,1-2H3,(H,15,16)/t10-,11+,12+,13-
InChIKey VGTIAGCVYBEACG-FNFFVJSTSA-N
Molecular Weight 223.316 g/mol
SMILES OC([C@]12C[C@]3(C[C@@](C2)(C)C[C@](C1)(C3)C)N)=O
SPLASH splash10-00di-4900000000-bd7e7af3196350c4666f
Synonyms 3-Amino-5,7-dimethyl-adamantane-1-carboxylic acid 3-Ammonio-5,7-dimethyl-1-adamantanecarboxylate 3-Ammonio-5,7-dimethyl-adamantane-1-carboxylate 3-Azaniumyl-5,7-dimethyl-adamantane-1-carboxylate 3-Azanyl-5,7-dimethyl-adamantane-1-carboxylic acid Adamantane-1-carboxylic acid, 3-amino-5,7-dimethyl-
Wiley ID 1456027