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(3R,6R,7E)-3-HYDROXY-4,7-MEGASTIGMADIEN-9-ONE
SpectraBase Compound ID GOnhPDYUamV
InChI InChI=1S/C13H20O2/c1-9-7-11(15)8-13(3,4)12(9)6-5-10(2)14/h5-7,11-12,15H,8H2,1-4H3/b6-5+/t11-,12-/m0/s1
InChIKey FDSNVAKZRJLMJN-WTIVYXKASA-N
Mol Weight 208.3 g/mol
Molecular Formula C13H20O2
Exact Mass 208.14633 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID RwW7FLfcFl
Name (E)-4-[(1R,4R)-2,6,6-trimethyl-4-oxidanyl-cyclohex-2-en-1-yl]but-3-en-2-one
Alternate Name(s) (E)-4-[(1R,4R)-4-hydroxy-2,6,6-trimethyl-1-cyclohex-2-enyl]-3-buten-2-one (E)-4-[(1R,4R)-4-hydroxy-2,6,6-trimethyl-cyclohex-2-en-1-yl]but-3-en-2-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H20O2
InChI InChI=1S/C13H20O2/c1-9-7-11(15)8-13(3,4)12(9)6-5-10(2)14/h5-7,11-12,15H,8H2,1-4H3/b6-5+/t11-,12-/m0/s1
InChIKey FDSNVAKZRJLMJN-WTIVYXKASA-N
Molecular Weight 208.301 g/mol
SMILES O[C@@]1(CC([C@](C(=C1)C)(\C=C\C(=O)C)[H])(C)C)[H]
SPLASH splash10-0006-9400000000-0fe16cbf990b520570cc
Source of Spectrum B-48-145-0
Wiley ID 1207304