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(S)-1-(Methoxymethoxy)hept-5-yn-2-ol
SpectraBase Compound ID 7SYWVJxbCdR
InChI InChI=1S/C9H16O3/c1-3-4-5-6-9(10)7-12-8-11-2/h9-10H,5-8H2,1-2H3/t9-/m0/s1
InChIKey MFAVUKLSLOROPG-VIFPVBQESA-N
Mol Weight 172.22 g/mol
Molecular Formula C9H16O3
Exact Mass 172.109944 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Bl1o8lx5mFD
Name (S)-1-(Methoxymethoxy)hept-5-yn-2-ol
Appearance Oil
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 172.109944372 u
Formula C9H16O3
InChI InChI=1S/C9H16O3/c1-3-4-5-6-9(10)7-12-8-11-2/h9-10H,5-8H2,1-2H3/t9-/m0/s1
InChIKey MFAVUKLSLOROPG-VIFPVBQESA-N
Instrument Name Finnigan MAT 8200
Ionization Type EI
Literature Reference DOI 10.1002/chem.201404873
Molecular Weight 172.224 g/mol
Optical Rotation [a]D20 = +12 (c = 1.1, CHCl3)
Quality 178
Reported Formula C9H16O3
SMILES O[C@](COCOC)(CCC#CC)[H]
SPLASH splash10-0002-9100000000-65b7a781ce9ed9665156
Source of Spectrum QE-21-SM15-55 (DOI: 10.1002/chem.201404873)
Wiley ID 1906285