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3-ethyl-1-pentyn-3-ol
SpectraBase Compound ID GO2Jab5uEpq
InChI InChI=1S/C7H12O/c1-4-7(8,5-2)6-3/h1,8H,5-6H2,2-3H3
InChIKey PUNRPAWKFTXZIW-UHFFFAOYSA-N
Mol Weight 112.17 g/mol
Molecular Formula C7H12O
Exact Mass 112.088815 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8Lpnt4j3KnG
Name 1-Pentyn-3-ol, 3-ethyl-
Alternate Name(s) 3-Ethyl-1-pentyn-3-ol 3-Aethyl-pentin-(1)-ol-(3) 3-Ethylpent-1-yn-3-ol 3-Pentanol, 3-ethynyl- Diaethyl-aethenyl-carbinol Diethylethynylcarbinol AI3-23405 BRN 1740944 EINECS 228-512-1 NSC 5588
CAS Registry Number 6285-06-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H12O
InChI InChI=1S/C7H12O/c1-4-7(8,5-2)6-3/h1,8H,5-6H2,2-3H3
InChIKey PUNRPAWKFTXZIW-UHFFFAOYSA-N
Molecular Weight 112.172 g/mol
SMILES OC(C#C)(CC)CC
SPLASH splash10-0059-9000000000-b2135988719821c1989c
Source of Spectrum JX-2015-6-5370
Wiley ID 1729105