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1-adamantyl acetaldehyde

View entire compound with spectra: 1 MS (GC)

1-adamantyl acetaldehyde
SpectraBase Compound ID Hw66VkYEFE1
InChI InChI=1S/C12H18O/c13-2-1-12-6-9-3-10(7-12)5-11(4-9)8-12/h2,9-11H,1,3-8H2/t9-,10+,11-,12+
InChIKey BLQURGBJSSSGAU-BKUVIOGVSA-N
Mol Weight 178.27 g/mol
Molecular Formula C12H18O
Exact Mass 178.135765 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Bv8j4Ei2FrW
Name 1-adamantyl acetaldehyde
Appearance Yellowish oil
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H18O
InChI InChI=1S/C12H18O/c13-2-1-12-6-9-3-10(7-12)5-11(4-9)8-12/h2,9-11H,1,3-8H2/t9-,10+,11-,12+
InChIKey BLQURGBJSSSGAU-BKUVIOGVSA-N
Ionization Type EI
Molecular Weight 178.275 g/mol
SMILES C12(C[C@]3(C[C@](C[C@@](C2)(C3)[H])(C1)[H])[H])CC=O
SPLASH splash10-000i-0900000000-f6d87134e837cf4c97ab
Source of Spectrum RU2612956C1
Wiley ID 1855322