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Clavulactone
SpectraBase Compound ID CLAd458DY2g
InChI InChI=1S/C20H28O3/c1-12-5-7-20(4)8-6-16-14(3)19(22)23-17(18(16)20)11-13(2)10-15(21)9-12/h5,13,17-18H,6-11H2,1-4H3/b12-5-/t13-,17-,18?,20-/m1/s1
InChIKey ONFCMUHTPSEVNW-VCSYYTALSA-N
Mol Weight 316.44 g/mol
Molecular Formula C20H28O3
Exact Mass 316.203845 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2JKq3JeUg9c
Name Clavulactone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H28O3
InChI InChI=1S/C20H28O3/c1-12-5-7-20(4)8-6-16-14(3)19(22)23-17(18(16)20)11-13(2)10-15(21)9-12/h5,13,17-18H,6-11H2,1-4H3/b12-5-/t13-,17-,18?,20-/m1/s1
InChIKey ONFCMUHTPSEVNW-VCSYYTALSA-N
Molecular Weight 316.441 g/mol
SMILES C12=C(C(=O)O[C@]3(C2[C@@](C\C=C/(CC(C[C@](C3)(C)[H])=O)C)(C)CC1)[H])C
SPLASH splash10-014r-8941000000-bab1ae91363f785db978
Source of Spectrum X2-54-384-1
Wiley ID 1603922