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2,2-Dimethyl-1-pentanol
SpectraBase Compound ID JNW3SBD93fU
InChI InChI=1S/C7H16O/c1-4-5-7(2,3)6-8/h8H,4-6H2,1-3H3
InChIKey QTOMCRXZFDHJOL-UHFFFAOYSA-N
Mol Weight 116.2 g/mol
Molecular Formula C7H16O
Exact Mass 116.120115 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LW3f6xfBA1v
Name 1-Pentanol, 2,2-dimethyl-
Alternate Name(s) 2,2-Dimethyl-1-pentanol 2,2-Dimethylpentan-1-ol 2,2-Dimethylpentanol Neoheptanol EINECS 219-132-7 NSC 62666
CAS Registry Number 2370-12-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H16O
InChI InChI=1S/C7H16O/c1-4-5-7(2,3)6-8/h8H,4-6H2,1-3H3
InChIKey QTOMCRXZFDHJOL-UHFFFAOYSA-N
Molecular Weight 116.204 g/mol
SMILES OCC(C)(CCC)C
SPLASH splash10-0006-9000000000-226826cb8fc614edf572
Source of Spectrum W5-1989-49896-15640
Wiley ID 1125958