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Nonanal, 4-methyl-7-methylene-6-oxo-, (S)-
SpectraBase Compound ID 8PplXI4gGiK
InChI InChI=1S/C11H18O2/c1-4-10(3)11(13)8-9(2)6-5-7-12/h7,9H,3-6,8H2,1-2H3/t9-/m0/s1
InChIKey LNDZMLVAYKNTPN-VIFPVBQESA-N
Mol Weight 182.26 g/mol
Molecular Formula C11H18O2
Exact Mass 182.13068 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5hd8iyvQ0SZ
Name Nonanal, 4-methyl-7-methylene-6-oxo-, (S)-
CAS Registry Number 82507-44-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H18O2
InChI InChI=1S/C11H18O2/c1-4-10(3)11(13)8-9(2)6-5-7-12/h7,9H,3-6,8H2,1-2H3/t9-/m0/s1
InChIKey LNDZMLVAYKNTPN-VIFPVBQESA-N
Molecular Weight 182.263 g/mol
SMILES C(C(=C)CC)(C[C@](CCC=O)(C)[H])=O
SPLASH splash10-001i-9100000000-3e07eb3eb1c627a6e995
Source of Spectrum J-55-5616-12
Synonyms (4S)-7-ethyl-4-methyl-6-oxo-7-octenal (S)-4-methyl-7-methylene-6-oxononanal
Wiley ID 1178855