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methyl cis-4-methyl-4-hydroxy-7-decen-2-ynoate
SpectraBase Compound ID 2YEtML3BbWs
InChI InChI=1S/C12H18O3/c1-4-5-6-7-9-12(2,14)10-8-11(13)15-3/h5-6,14H,4,7,9H2,1-3H3/b6-5-
InChIKey BUTRABYBDXSOEF-WAYWQWQTSA-N
Mol Weight 210.27 g/mol
Molecular Formula C12H18O3
Exact Mass 210.125594 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BF5NxLYvSlM
Name methyl cis-4-methyl-4-hydroxy-7-decen-2-ynoate
Appearance Colorless oil
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H18O3
InChI InChI=1S/C12H18O3/c1-4-5-6-7-9-12(2,14)10-8-11(13)15-3/h5-6,14H,4,7,9H2,1-3H3/b6-5-
InChIKey BUTRABYBDXSOEF-WAYWQWQTSA-N
Instrument Name GCMS
Ionization Type EI
Molecular Weight 210.273 g/mol
SMILES OC(C#CC(OC)=O)(CC\C=C/CC)C
SPLASH splash10-0006-9200000000-68db0d056fc709055018
Source of Spectrum CN106632162A
Wiley ID 1870485