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[1,1-D2]-2a-Methyl-2,2a,7,7a-tetrahydro-1H-cyclobut[a]inden-2-one
SpectraBase Compound ID F7jEo6J6vgz
InChI InChI=1S/C12H12O/c1-12-9(7-11(12)13)6-8-4-2-3-5-10(8)12/h2-5,9H,6-7H2,1H3/i7D2
InChIKey AVDKJNWGNWDDSH-RJSZUWSASA-N
Mol Weight 174.24 g/mol
Molecular Formula C12H102D2O
Exact Mass 174.101368 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EAZaXPyyEnX
Name [1,1-D2]-2a-Methyl-2,2a,7,7a-tetrahydro-1H-cyclobut[a]inden-2-one
Alternate Name(s) 2a-methyl-1,2a,7,7a-tetrahydro-2H-cyclobuta[a]inden-2-one-1,1-d2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H10D2O
InChI InChI=1S/C12H12O/c1-12-9(7-11(12)13)6-8-4-2-3-5-10(8)12/h2-5,9H,6-7H2,1H3/i7D2
InChIKey AVDKJNWGNWDDSH-RJSZUWSASA-N
Molecular Weight 174.239 g/mol
SMILES c1cc2c(cc1)CC1C2(C(C1([2D])[2D])=O)C
SPLASH splash10-001i-0900000000-8e0392715bf44057cb09
Source of Spectrum K-108-200-200_1
Wiley ID 1793800