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4H-Inden-4-one, 3,3a,5,6,7,7a-hexahydro-3-methyl-, (3.alpha.,3a.alpha.,7a.alpha.)-
SpectraBase Compound ID 3Lp3Vx0fhLD
InChI InChI=1S/C10H14O/c1-7-5-6-8-3-2-4-9(11)10(7)8/h5-8,10H,2-4H2,1H3/t7-,8-,10+/m0/s1
InChIKey ZTHJRRKSDFPHBS-OYNCUSHFSA-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 KFMSnmbfOve
Name 4H-Inden-4-one, 3,3a,5,6,7,7a-hexahydro-3-methyl-, (3.alpha.,3a.alpha.,7a.alpha.)-
CAS Registry Number 77494-82-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H14O
InChI InChI=1S/C10H14O/c1-7-5-6-8-3-2-4-9(11)10(7)8/h5-8,10H,2-4H2,1H3/t7-,8-,10+/m0/s1
InChIKey ZTHJRRKSDFPHBS-OYNCUSHFSA-N
Molecular Weight 150.221 g/mol
SMILES C1=C[C@](C)([C@@]2([C@]1(CCCC2=O)[H])[H])[H]
SPLASH splash10-0fi3-5900000000-4a5baa78f34498f6a377
Source of Spectrum J-46-2915-0
Synonyms (3S,3aR,7aS)-3-methyl-3,3a,5,6,7,7a-hexahydro-4H-inden-4-one 9-.alpha.-methylbicyclo[4.3.0]non-7-en-2-one
Wiley ID 1147508