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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 DsyfyYpXo0n
Name 3-BROMO-7-METHYL-1-ADAMANTANECARBOXYLIC ACID
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. 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 272.0407
SMILES OC(=O)[C@]12C[C@@]3(Br)C[C@@](C)(C2)C[C@](C3)(C1)[H]
SPLASH splash10-0006-9200000000-e083202f9b4868650420
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany