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ZIZA-6(13)-EN-3-ONE;REFERENCE
SpectraBase Compound ID 5QTqgqOHQy2
InChI InChI=1S/C15H22O/c1-9-12-7-13(16)10(2)15(12)6-5-11(8-15)14(9,3)4/h10-12H,1,5-8H2,2-4H3/t10-,11+,12+,15-/m0/s1
InChIKey RVQOGXCBZWSGSS-YFCNSXCBSA-N
Mol Weight 218.34 g/mol
Molecular Formula C15H22O
Exact Mass 218.167065 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID K4mV9ice5oI
Name 1H-3a,6-Methanoazulen-2(3H)-one, hexahydro-3,7,7-trimethyl-8-methylene-, (3R,3aR,6R,8aS)-
CAS Registry Number 28051-97-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H22O
InChI InChI=1S/C15H22O/c1-9-12-7-13(16)10(2)15(12)6-5-11(8-15)14(9,3)4/h10-12H,1,5-8H2,2-4H3/t10-,11+,12+,15-/m0/s1
InChIKey RVQOGXCBZWSGSS-YFCNSXCBSA-N
Molecular Weight 218.340 g/mol
SMILES [C@@]123[C@@](C(=C)C([C@](C3)([H])CC1)(C)C)(CC([C@@]2(C)[H])=O)[H]
SPLASH splash10-05dm-4910000000-ddfb69d568519fc8e1ce
Source of Spectrum J-49-3831-0
Synonyms 1H-3a,6-Methanoazulen-2(3H)-one, hexahydro-3,7,7-trimethyl-8-methylene-, [3R-(3.alpha.,3a.alpha.,6.alpha.,8a.alpha.)]- (1R,2R,5S,8R)-2,7,7-trimethyl-6-methylenetricyclo[6.2.1.0(1,5)]undecan-3-one 3-Zizanone
Wiley ID 1218207