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5-chloranyl-3-[(2E)-3,7-dimethylocta-2,6-dienyl]-2,4-bis(methoxymethoxy)-6-methyl-benzaldehyde
SpectraBase Compound ID COaXdmlYWq8
InChI InChI=1S/C22H31ClO5/c1-15(2)8-7-9-16(3)10-11-18-21(27-13-25-5)19(12-24)17(4)20(23)22(18)28-14-26-6/h8,10,12H,7,9,11,13-14H2,1-6H3/b16-10+
InChIKey NONINMHTUPUSAC-MHWRWJLKSA-N
Mol Weight 410.94 g/mol
Molecular Formula C22H31ClO5
Exact Mass 410.186002 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6Tusw9kV8Aa
Name 5-chloranyl-3-[(2E)-3,7-dimethylocta-2,6-dienyl]-2,4-bis(methoxymethoxy)-6-methyl-benzaldehyde
Alternate Name(s) 5-chloro-3-[(2E)-3,7-dimethylocta-2,6-dienyl]-2,4-bis(methoxymethoxy)-6-methyl-benzaldehyde
Comments Less than 3 mono-isotopic peaks
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Formula C22H31ClO5
InChI InChI=1S/C22H31ClO5/c1-15(2)8-7-9-16(3)10-11-18-21(27-13-25-5)19(12-24)17(4)20(23)22(18)28-14-26-6/h8,10,12H,7,9,11,13-14H2,1-6H3/b16-10+
InChIKey NONINMHTUPUSAC-MHWRWJLKSA-N
Molecular Weight 410.938 g/mol
SMILES c1(c(c(C=O)c(c(c1OCOC)Cl)C)OCOC)C\C=C\(CCC=C(C)C)C
SPLASH splash10-0002-9000000000-a0abab0f65bb34c938ba
Source of Spectrum AJ-67-1183-18
Wiley ID 772684