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Rugosic acid C
SpectraBase Compound ID IjQ2ATWQxRA
InChI InChI=1S/C15H24O5/c1-8(2)10-4-5-14(3)7-11(16)9(13(18)19)6-12(17)15(10,14)20/h6,8,10-12,16-17,20H,4-5,7H2,1-3H3,(H,18,19)/t10-,11+,12+,14-,15+/m1/s1
InChIKey OOLTYBWQVKVCOH-NUNXZZDCSA-N
Mol Weight 284.35 g/mol
Molecular Formula C15H24O5
Exact Mass 284.162374 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4wWiATPlQm
Name Rugosic acid C
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H24O5
InChI InChI=1S/C15H24O5/c1-8(2)10-4-5-14(3)7-11(16)9(13(18)19)6-12(17)15(10,14)20/h6,8,10-12,16-17,20H,4-5,7H2,1-3H3,(H,18,19)/t10-,11+,12+,14-,15+/m1/s1
InChIKey OOLTYBWQVKVCOH-NUNXZZDCSA-N
Molecular Weight 284.352 g/mol
SMILES O[C@]1(C[C@]2(CC[C@@]([C@@]2([C@](C=C1C(=O)O)(O)[H])O)(C(C)C)[H])C)[H]
SPLASH splash10-0007-9510000000-0408ac1b506f84b3d6df
Source of Spectrum LQ-1992-3901-0
Synonyms (1R,3aR,5S,8S,8aR)-5,8,8a-trihydroxy-1-isopropyl-3a-methyl-1,2,3,3a,4,5,8,8a-octahydro-6-azulenecarboxylic acid
Wiley ID 1287779