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3-Bromo-7-methyl-1-adamantanecarboxylic acid
SpectraBase Compound ID HPulqY71XkW
InChI InChI=1S/C12H17BrO2/c1-10-2-8-3-11(5-10,9(14)15)7-12(13,4-8)6-10/h8H,2-7H2,1H3,(H,14,15)/t8-,10+,11+,12-/m0/s1
InChIKey AQYMJKFAOHCXOD-GMNPVEAJSA-N
Mol Weight 273.17 g/mol
Molecular Formula C12H17BrO2
Exact Mass 272.041193 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HfnXOmJmX2J
Name 3-Bromo-7-methyl-1-adamantanecarboxylic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H17BrO2
InChI InChI=1S/C12H17BrO2/c1-10-2-8-3-11(5-10,9(14)15)7-12(13,4-8)6-10/h8H,2-7H2,1H3,(H,14,15)/t8-,10+,11+,12-/m0/s1
InChIKey AQYMJKFAOHCXOD-GMNPVEAJSA-N
Molecular Weight 273.170 g/mol
SMILES OC([C@]12C[C@]3(C[C@@](C2)(C[C@@](C1)(C3)Br)[H])C)=O
SPLASH splash10-0006-9200000000-e083202f9b4868650420
Synonyms 3-Bromanyl-5-methyl-adamantane-1-carboxylic acid 3-Bromo-5-methyl-1-adamantanecarboxylic acid 3-Bromo-5-methyl-adamantane-1-carboxylic acid
Wiley ID 1470514