2,5-Dimethyl-2,5-hexandiol

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Systematic / IUPAC Name: 2,5-Dimethyl-2,5-hexanediol

ID: Reference605

Other Names: 2,5-Dimethylhexane-2,5-diol;
2,5-Hexanediol, 2,5-dimethyl-;
1,1,4,4-Tetramethyl-1,4-butanediol;
2,5-Dihydroxy-2,5-dimethylhexane;
Dimethylhexanediol

Formula: C8H18O2

Spectral Data

2,5-Dimethyl-2,5-hexandiol mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.

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Available MS Data

Used Instruments Q Exactive Orbitrap
No. of Spectral Trees 1
No. of Spectra 71
Tandem Spectra MS1, MS2
Ionization Methods ESI
Analyzers FT
Last Modification 2/11/2015 2:50:33 PM
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Identificators

InChI InChI=1S/C8H18O2/c1-7(2,9)5-6-8(3,4)10/h9-10H,5-6H2,1-4H3
InChI Key ZWNMRZQYWRLGMM-UHFFFAOYSA-N
Canonical SMILES CC(C)(CCC(C)(C)O)O
CAS 110032
Splash
Other Names 2,5-Dimethylhexane-2,5-diol;
2,5-Hexanediol, 2,5-dimethyl-;
1,1,4,4-Tetramethyl-1,4-butanediol;
2,5-Dihydroxy-2,5-dimethylhexane;
Dimethylhexanediol;
2,5-Dimethylhexanediol

In Other Databases

ChEMBL CHEMBL1476371
ChemIDPlus 000110032
PubChem 8031
ChemSpider 7740