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Kotolactone B

View entire compound with spectra: 1 MS (GC)

Kotolactone B
SpectraBase Compound ID 3PhQTVGUvhD
InChI InChI=1S/C33H60O4/c1-4-6-8-10-12-14-16-18-19-21-23-25-27-29-31-33(3,37-32(29)34)36-30(35-31)28-26-24-22-20-17-15-13-11-9-7-5-2/h27,30-31H,4-26,28H2,1-3H3/b29-27+/t30-,31-,33+/m0/s1
InChIKey XOBIKJVESDPFSM-OYQBLGGWSA-N
Mol Weight 520.8 g/mol
Molecular Formula C33H60O4
Exact Mass 520.44916 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EcidZwULIuc
Name Kotolactone B
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C33H60O4
InChI InChI=1S/C33H60O4/c1-4-6-8-10-12-14-16-18-19-21-23-25-27-29-31-33(3,37-32(29)34)36-30(35-31)28-26-24-22-20-17-15-13-11-9-7-5-2/h27,30-31H,4-26,28H2,1-3H3/b29-27+/t30-,31-,33+/m0/s1
InChIKey XOBIKJVESDPFSM-OYQBLGGWSA-N
Molecular Weight 520.839 g/mol
SMILES [C@@]12(OC(=O)\C([C@@]2(O[C@@](O1)(CCCCCCCCCCCCC)[H])[H])=C\CCCCCCCCCCCCC)C
SPLASH splash10-0006-1390000000-ddde966497e46d25fc9c
Source of Spectrum X2-68-1322-2
Wiley ID 1609691