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4-(1-Adamantyl)-6-bromo-2-hydroxymethylphenol
SpectraBase Compound ID C5Fg69E4fB3
InChI InChI=1S/C17H21BrO2/c18-15-5-14(4-13(9-19)16(15)20)17-6-10-1-11(7-17)3-12(2-10)8-17/h4-5,10-12,19-20H,1-3,6-9H2/t10-,11+,12-,17-
InChIKey JIHIGNSGOPCMPJ-KVMGNAQRSA-N
Mol Weight 337.26 g/mol
Molecular Formula C17H21BrO2
Exact Mass 336.072493 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CIG9kTCoEqF
Name 4-(1-Adamantyl)-6-bromo-2-hydroxymethylphenol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H21BrO2
InChI InChI=1S/C17H21BrO2/c18-15-5-14(4-13(9-19)16(15)20)17-6-10-1-11(7-17)3-12(2-10)8-17/h4-5,10-12,19-20H,1-3,6-9H2/t10-,11+,12-,17-
InChIKey JIHIGNSGOPCMPJ-KVMGNAQRSA-N
Molecular Weight 337.257 g/mol
SMILES OCc1cc(cc(c1O)Br)C12C[C@]3(C[C@@](C2)(C[C@@](C1)(C3)[H])[H])[H]
SPLASH splash10-00xr-0319000000-7065cc7aa4043ed5ce7c
Source of Spectrum HC-47-903-2f
Synonyms 4-((3r,5r,7r)-adamantan-1-yl)-2-bromo-6-(hydroxymethyl)phenol
Wiley ID 1734144