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1,6-Pentalenedione, hexahydro-6a-(2-propynyl)-, cis-
SpectraBase Compound ID 8ISEVS7wFK
InChI InChI=1S/C11H12O2/c1-2-7-11-8(3-5-9(11)12)4-6-10(11)13/h1,8H,3-7H2
InChIKey ZDNCMKYOYHVDBC-UHFFFAOYSA-N
Mol Weight 176.21 g/mol
Molecular Formula C11H12O2
Exact Mass 176.08373 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IknEqz9TSNt
Name 1,6-Pentalenedione, hexahydro-6a-(2-propynyl)-, cis-
Alternate Name(s) 6a-(2-Propynyl)hexahydro-1,6-pentalenedione 6a-prop-2-ynyl-3,3a,4,5-tetrahydro-2H-pentalene-1,6-dione 6a-propargyl-3,3a,4,5-tetrahydro-2H-pentalene-1,6-quinone
CAS Registry Number 92485-87-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H12O2
InChI InChI=1S/C11H12O2/c1-2-7-11-8(3-5-9(11)12)4-6-10(11)13/h1,8H,3-7H2
InChIKey ZDNCMKYOYHVDBC-UHFFFAOYSA-N
Molecular Weight 176.215 g/mol
SMILES C#CCC12C(CCC1CCC2=O)=O
SPLASH splash10-002f-9600000000-75803f4938b38d04be37
Source of Spectrum H-67-861-0
Wiley ID 1172409