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5-(4-Bromophenyl)-2,3-dimethylpent-4-yne-2,3-diol
SpectraBase Compound ID Fe89mRdoBaL
InChI InChI=1S/C13H15BrO2/c1-12(2,15)13(3,16)9-8-10-4-6-11(14)7-5-10/h4-7,15-16H,1-3H3
InChIKey BHYJAXXSFQATPS-UHFFFAOYSA-N
Mol Weight 283.16 g/mol
Molecular Formula C13H15BrO2
Exact Mass 282.025543 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8psByHLAOdZ
Name 5-(4-Bromophenyl)-2,3-dimethylpent-4-yne-2,3-diol
Alternate Name(s) 5-(4-bromophenyl)-2,3-dimethyl-4-pentyne-2,3-diol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H15BrO2
InChI InChI=1S/C13H15BrO2/c1-12(2,15)13(3,16)9-8-10-4-6-11(14)7-5-10/h4-7,15-16H,1-3H3
InChIKey BHYJAXXSFQATPS-UHFFFAOYSA-N
Literature Reference DOI 10.1021/jo301628n
Molecular Weight 283.165 g/mol
SMILES OC(C(O)(C#Cc1ccc(cc1)Br)C)(C)C
SPLASH splash10-0a4i-3390000000-875ec879d2fd0122483a
Source of Spectrum J-77-8666-3d
Wiley ID 1747082