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Violascensol 6-oxodecaoctanoic ester
SpectraBase Compound ID 8v7Kk9NyQcO
InChI InChI=1S/C33H54O4/c1-5-6-7-8-9-10-11-12-13-14-15-17-27(34)18-16-19-30(36)37-24-32(3)21-26-20-25(2)31-29(35)23-33(31,4)28(26)22-32/h26,28H,5-24H2,1-4H3/t26?,28-,32-,33-/m1/s1
InChIKey NDXBNIHJFXQYGO-ZMNHNITNSA-N
Mol Weight 514.8 g/mol
Molecular Formula C33H54O4
Exact Mass 514.40221 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7SickHSWfJ0
Name Violascensol 6-oxodecaoctanoic ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C33H54O4
InChI InChI=1S/C33H54O4/c1-5-6-7-8-9-10-11-12-13-14-15-17-27(34)18-16-19-30(36)37-24-32(3)21-26-20-25(2)31-29(35)23-33(31,4)28(26)22-32/h26,28H,5-24H2,1-4H3/t26?,28-,32-,33-/m1/s1
InChIKey NDXBNIHJFXQYGO-ZMNHNITNSA-N
Molecular Weight 514.791 g/mol
SMILES [C@]12(C(=C(CC3[C@]2(C[C@@](COC(=O)CCCC(=O)CCCCCCCCCCCCC)(C)C3)[H])C)C(=O)C1)C
SPLASH splash10-014i-2930000000-8f16e5940d85eafd840a
Source of Spectrum AT-39-1960-2
Wiley ID 854123