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1H-Cycloprop[e]azulene-3,7-diol, decahydro-1,1,7-trimethyl-4-methylene-, 3-acetate, [1aR-(1a.alpha.,3.beta.,4a.alpha.,7.beta.,7a.beta.,7b.alpha.)]-
SpectraBase Compound ID JOjTjKSuT2m
InChI InChI=1S/C17H26O3/c1-9-11-6-7-17(5,19)14(11)15-12(16(15,3)4)8-13(9)20-10(2)18/h11-15,19H,1,6-8H2,2-5H3/t11-,12+,13-,14+,15+,17-/m0/s1
InChIKey MBGBMFZQBMILOF-RPCDLPGOSA-N
Mol Weight 278.39 g/mol
Molecular Formula C17H26O3
Exact Mass 278.188195 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Altd8VQ5eZF
Name 1H-Cycloprop[e]azulene-3,7-diol, decahydro-1,1,7-trimethyl-4-methylene-, 3-acetate, [1aR-(1a.alpha.,3.beta.,4a.alpha.,7.beta.,7a.beta.,7b.alpha.)]-
Alternate Name(s) (1aR,3S,4aR,7S,7aR,7bR)-7-hydroxy-1,1,7-trimethyl-4-methylenedecahydro-1H-cyclopropa[e]azulen-3-yl acetate 4.beta.-hydroxy-9.beta.-acetoxyaromadendrene
CAS Registry Number 123688-32-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H26O3
InChI InChI=1S/C17H26O3/c1-9-11-6-7-17(5,19)14(11)15-12(16(15,3)4)8-13(9)20-10(2)18/h11-15,19H,1,6-8H2,2-5H3/t11-,12+,13-,14+,15+,17-/m0/s1
InChIKey MBGBMFZQBMILOF-RPCDLPGOSA-N
Molecular Weight 278.392 g/mol
SMILES O[C@@]1([C@]2([C@@]3(C(C)(C)[C@@]3(C[C@](OC(=O)C)(C([C@@]2(CC1)[H])=C)[H])[H])[H])[H])C
SPLASH splash10-0gvk-0930000000-38fb29c22ec9e4f484e8
Source of Spectrum I-67-1291-8
Wiley ID 1282302