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1(3aH)-Pentalenone, 4,5,6,6a-tetrahydro-6,6a-dimethyl-, (3a.alpha.,6.beta.,6a.alpha.)-
SpectraBase Compound ID Gs5c58TLY5Z
InChI InChI=1S/C10H14O/c1-7-3-4-8-5-6-9(11)10(7,8)2/h5-8H,3-4H2,1-2H3/t7-,8-,10-/m1/s1
InChIKey QSFXIRAVTYTMEY-NQMVMOMDSA-N
Mol Weight 150.22 g/mol
Molecular Formula C10H14O
Exact Mass 150.104465 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6UCvyUtrBLJ
Name 1(3aH)-Pentalenone, 4,5,6,6a-tetrahydro-6,6a-dimethyl-, (3a.alpha.,6.beta.,6a.alpha.)-
CAS Registry Number 81825-32-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H14O
InChI InChI=1S/C10H14O/c1-7-3-4-8-5-6-9(11)10(7,8)2/h5-8H,3-4H2,1-2H3/t7-,8-,10-/m1/s1
InChIKey QSFXIRAVTYTMEY-NQMVMOMDSA-N
Molecular Weight 150.221 g/mol
SMILES [C@]12(C(C=C[C@]2(CC[C@]1(C)[H])[H])=O)C
SPLASH splash10-0pdi-9600000000-331c0a3898113121795b
Source of Spectrum H-65-24-0
Synonyms (1R*,5R*,8R*)-1,8-dimethylbicyclo[3.3.0]oct-3-en-2-one (3aR,6R,6aR)-6,6a-dimethyl-4,5,6,6a-tetrahydro-1(3aH)-pentalenone
Wiley ID 1147492