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3a.beta.-Methyl-3,3a-dihydro-1,4-(2H,6a.beta.H)-pentalenedione
SpectraBase Compound ID L3sZ3WC7p4n
InChI InChI=1S/C9H10O2/c1-9-5-4-7(10)6(9)2-3-8(9)11/h2-3,6H,4-5H2,1H3/t6-,9+/m1/s1
InChIKey PMVPSOKFROTRSB-MUWHJKNJSA-N
Mol Weight 150.18 g/mol
Molecular Formula C9H10O2
Exact Mass 150.06808 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3YZIXZbEXM7
Name 3a.beta.-Methyl-3,3a-dihydro-1,4-(2H,6a.beta.H)-pentalenedione
CAS Registry Number 75400-29-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H10O2
InChI InChI=1S/C9H10O2/c1-9-5-4-7(10)6(9)2-3-8(9)11/h2-3,6H,4-5H2,1H3/t6-,9+/m1/s1
InChIKey PMVPSOKFROTRSB-MUWHJKNJSA-N
Molecular Weight 150.177 g/mol
SMILES [C@]12([C@](C=CC2=O)(C(=O)CC1)[H])C
SPLASH splash10-0a4i-9600000000-37960732825f0f583faa
Source of Spectrum J-46-11-0
Synonyms (3aS,6aS)-3a-methyl-2,3,3a,6a-tetrahydro-1,4-pentalenedione
Wiley ID 1147046