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3-(4-(2-hydroxy-2-methylpropyl)cyclohex-1-en-1-yl)propanal
SpectraBase Compound ID 8iugtlNZhQZ
InChI InChI=1S/C13H22O2/c1-13(2,15)10-12-7-5-11(6-8-12)4-3-9-14/h5,9,12,15H,3-4,6-8,10H2,1-2H3
InChIKey SZAZCKWZIAIBMB-UHFFFAOYSA-N
Mol Weight 210.32 g/mol
Molecular Formula C13H22O2
Exact Mass 210.16198 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Hmp4A9WLvyu
Name 3-(4-(2-hydroxy-2-methylpropyl)cyclohex-1-en-1-yl)propanal
Appearance Colorless oil
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H22O2
InChI InChI=1S/C13H22O2/c1-13(2,15)10-12-7-5-11(6-8-12)4-3-9-14/h5,9,12,15H,3-4,6-8,10H2,1-2H3
InChIKey SZAZCKWZIAIBMB-UHFFFAOYSA-N
Instrument Name MSD5975
Ionization Type EI
Molecular Weight 210.317 g/mol
SMILES OC(CC1CC=C(CC1)CCC=O)(C)C
SPLASH splash10-014l-9800000000-ec88504c243b7d933e78
Source of Spectrum WO2020201052A1
Wiley ID 1877334