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Buten-1-ol acetate<3-methyl-3->
SpectraBase Compound ID 89xAjvELPOv
InChI InChI=1S/C7H12O2/c1-6(2)4-5-9-7(3)8/h1,4-5H2,2-3H3
InChIKey OCUAPVNNQFAQSM-UHFFFAOYSA-N
Mol Weight 128.17 g/mol
Molecular Formula C7H12O2
Exact Mass 128.08373 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LkarECtl4CZ
Name 3-Methyl-3-buten-1-ol acetate
CAS Registry Number 5205-07-2
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H12O2
GC Column J&W DB-5 (30 m x 0.25 mm ID x 0.25 ??m film thickness)
GC Oven Program 60 ??C to 246 ??C at 3 ??C/min.
InChI InChI=1S/C7H12O2/c1-6(2)4-5-9-7(3)8/h1,4-5H2,2-3H3
InChIKey OCUAPVNNQFAQSM-UHFFFAOYSA-N
Molecular Weight 128.171 g/mol
SMILES C=C(CCOC(C)=O)C
SPLASH splash10-00kf-9000000000-57783cfca6e7ed27f17b
Source of Spectrum Adams' Essential Oil Components (GC-MS), Version 4
Synonyms Buten-1-ol acetate<3-methyl-3->
Wiley ID 1887219