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(1s,2s,3e,7s,8r,11s,12z)-7-acetoxy-8,11-dihydroxycembra-3,12,15-trien-17,2-olide
SpectraBase Compound ID 1dzgthcuD71
InChI InChI=1S/C22H32O6/c1-13-6-9-20(27-16(4)23)22(5,26)11-10-18(24)14(2)7-8-17-15(3)21(25)28-19(17)12-13/h7,12,17-20,24,26H,3,6,8-11H2,1-2,4-5H3/b13-12-,14-7-
InChIKey XRJDKHSLEVYNJE-LRRHXLOMSA-N
Mol Weight 392.5 g/mol
Molecular Formula C22H32O6
Exact Mass 392.219889 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CLFTkkrN5Gd
Name (1s,2s,3e,7s,8r,11s,12z)-7-acetoxy-8,11-dihydroxycembra-3,12,15-trien-17,2-olide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H32O6
InChI InChI=1S/C22H32O6/c1-13-6-9-20(27-16(4)23)22(5,26)11-10-18(24)14(2)7-8-17-15(3)21(25)28-19(17)12-13/h7,12,17-20,24,26H,3,6,8-11H2,1-2,4-5H3/b13-12-,14-7-
InChIKey XRJDKHSLEVYNJE-LRRHXLOMSA-N
Ionization Type EI-B
Molecular Weight 392.492 g/mol
SMILES OC1(CCC(\C(=C/CC2C(\C=C/(CCC1OC(C)=O)C)OC(C2=C)=O)C)O)C
SPLASH splash10-0006-9620000000-cd06852a7496f900dd71
Source of Spectrum SRH-2022-10659-0
Wiley ID 1832271