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1-Butanol, 2,2-dimethyl-
SpectraBase Compound ID 7mLIkyhDGgo
InChI InChI=1S/C6H14O/c1-4-6(2,3)5-7/h7H,4-5H2,1-3H3
InChIKey XRMVWAKMXZNZIL-UHFFFAOYSA-N
Mol Weight 102.18 g/mol
Molecular Formula C6H14O
Exact Mass 102.104465 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4bTKIxu8iOk
Name 1-Butanol, 2,2-dimethyl-
CAS Registry Number 1185-33-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C6H14O
InChI InChI=1S/C6H14O/c1-4-6(2,3)5-7/h7H,4-5H2,1-3H3
InChIKey XRMVWAKMXZNZIL-UHFFFAOYSA-N
Molecular Weight 102.177 g/mol
SMILES OCC(C)(CC)C
SPLASH splash10-0096-9000000000-16d4971d4558c004cf15
Source of Spectrum NP-0-2283-0
Synonyms 2,2-Dimethyl-1-butanol 2,2-Dimethylbutan-1-ol 2,2-Dimethylbutanol BRN 1731439 EINECS 214-681-9 NSC 35406
Wiley ID 1094952