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(3aR,4R,7R)-1,4,9,9-Tetramethyl-3,4,5,6,7,8-hexahydro-2H-3a,7-methanoazulen-2-one
SpectraBase Compound ID 3yyXVRQxsRD
InChI InChI=1S/C15H22O/c1-9-11-7-10-5-6-15(4,14(10,2)3)12(11)8-13(9)16/h10,12H,5-8H2,1-4H3/t10-,12-,15-/m1/s1
InChIKey UUXICWBSFZDYLB-IXPVHAAZSA-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 JGwruSDxaMa
Name (3aR,4R,7R)-1,4,9,9-Tetramethyl-3,4,5,6,7,8-hexahydro-2H-3a,7-methanoazulen-2-one
CAS Registry Number 3466-15-7
Classification Chemical
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 218.167065327 u
Formula C15H22O
InChI InChI=1S/C15H22O/c1-9-11-7-10-5-6-15(4,14(10,2)3)12(11)8-13(9)16/h10,12H,5-8H2,1-4H3/t10-,12-,15-/m1/s1
InChIKey UUXICWBSFZDYLB-IXPVHAAZSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 218.340 g/mol
Nominal Mass 218 u
Quality 929
Retention Index 1657
SMILES [C@]12(C([C@@](CC=3[C@]2(CC(C3C)=O)[H])(CC1)[H])(C)C)C
SPLASH splash10-014i-6920000000-528b7028ba507f6422ea
Source of Spectrum DigiLab GmbH (C) 2024
Technique GC/MS
Wiley ID DD2024_026398