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Pectinolide A

View entire compound with spectra: 1 MS (GC)

Pectinolide A
SpectraBase Compound ID I7IwapVpTg0
InChI InChI=1S/C16H22O6/c1-4-5-6-13(20-11(2)17)7-8-15-14(21-12(3)18)9-10-16(19)22-15/h7-10,13-15H,4-6H2,1-3H3/b8-7-/t13?,14-,15-/m0/s1
InChIKey ALTFKBHIGVQJSX-SIZUHRPPSA-N
Mol Weight 310.35 g/mol
Molecular Formula C16H22O6
Exact Mass 310.141638 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8lQYbaMUUCW
Name Pectinolide A
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H22O6
InChI InChI=1S/C16H22O6/c1-4-5-6-13(20-11(2)17)7-8-15-14(21-12(3)18)9-10-16(19)22-15/h7-10,13-15H,4-6H2,1-3H3/b8-7-/t13?,14-,15-/m0/s1
InChIKey ALTFKBHIGVQJSX-SIZUHRPPSA-N
Molecular Weight 310.346 g/mol
SMILES C1(O[C@]([C@](C=C1)(OC(=O)C)[H])(\C=C/C(OC(=O)C)CCCC)[H])=O
SPLASH splash10-0006-9200000000-c4e6ce8dee871f5e35f6
Source of Spectrum X2-56-591-1
Wiley ID 1604817