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3-Acetamido-1-adamantanecarboxylic acid
SpectraBase Compound ID 9ydxoYtlg7K
InChI InChI=1S/C13H19NO3/c1-8(15)14-13-5-9-2-10(6-13)4-12(3-9,7-13)11(16)17/h9-10H,2-7H2,1H3,(H,14,15)(H,16,17)/t9-,10+,12+,13-
InChIKey XBMPXAYRLNNWET-QZHINBJYSA-N
Mol Weight 237.3 g/mol
Molecular Formula C13H19NO3
Exact Mass 237.136493 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HaD8gk3Ajrc
Name 3-Acetamido-1-adamantanecarboxylic acid
Alternate Name(s) 3-Acetamidoadamantane-1-carboxylic acid Adamantane-1-carboxylic acid, 3-acetylamino-
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H19NO3
InChI InChI=1S/C13H19NO3/c1-8(15)14-13-5-9-2-10(6-13)4-12(3-9,7-13)11(16)17/h9-10H,2-7H2,1H3,(H,14,15)(H,16,17)/t9-,10+,12+,13-
InChIKey XBMPXAYRLNNWET-QZHINBJYSA-N
Molecular Weight 237.299 g/mol
SMILES OC([C@]12C[C@]3(C[C@@](C2)(C[C@@](C1)(C3)[H])[H])NC(=O)C)=O
SPLASH splash10-0006-6910000000-77890fc879e343786c10
Wiley ID 1441453