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2-(5-isopropyl-2-methyl-cyclohex-2-ene-1-yl)acetaldehyde
SpectraBase Compound ID 4vNrz9x7TBM
InChI InChI=1S/C12H20O/c1-9(2)11-5-4-10(3)12(8-11)6-7-13/h4,7,9,11-12H,5-6,8H2,1-3H3
InChIKey JDNJBBUFRMMZBV-UHFFFAOYSA-N
Mol Weight 180.29 g/mol
Molecular Formula C12H20O
Exact Mass 180.151415 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BOGW8UPk7Ic
Name 2-(5-isopropyl-2-methyl-cyclohex-2-ene-1-yl)acetaldehyde
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H20O
InChI InChI=1S/C12H20O/c1-9(2)11-5-4-10(3)12(8-11)6-7-13/h4,7,9,11-12H,5-6,8H2,1-3H3
InChIKey JDNJBBUFRMMZBV-UHFFFAOYSA-N
Instrument Name GCMS
Ionization Type EI
Molecular Weight 180.291 g/mol
SMILES C(C1CC(CC=O)C(C)=CC1)(C)C
SPLASH splash10-0006-9300000000-bfbc5da76064bd9b9ea8
Sample Comments Isomer 1
Source of Spectrum WO2020057741A1
Wiley ID 1875147