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1H-Inden-1-one, 2,3,3a,4,5,7a-hexahydro-, cis-
SpectraBase Compound ID 1UUdBXgDvlN
InChI InChI=1S/C9H12O/c10-9-6-5-7-3-1-2-4-8(7)9/h2,4,7-8H,1,3,5-6H2/t7-,8-/m1/s1
InChIKey LQQITVPNPBZYRY-HTQZYQBOSA-N
Mol Weight 136.19 g/mol
Molecular Formula C9H12O
Exact Mass 136.088815 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1icZlXN5Ybr
Name 1H-Inden-1-one, 2,3,3a,4,5,7a-hexahydro-, cis-
CAS Registry Number 40954-59-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H12O
InChI InChI=1S/C9H12O/c10-9-6-5-7-3-1-2-4-8(7)9/h2,4,7-8H,1,3,5-6H2/t7-,8-/m1/s1
InChIKey LQQITVPNPBZYRY-HTQZYQBOSA-N
Molecular Weight 136.194 g/mol
SMILES [C@]12(C(CC[C@]2(CCC=C1)[H])=O)[H]
SPLASH splash10-014u-2900000000-98c819d64c465ebcb6f2
Source of Spectrum AJ-59-542-5
Synonyms (3aR,7aS)-2,3,3a,4,5,7a-hexahydro-1H-inden-1-one cis-bicyclo[4.3.0]non-4-en-7-one
Wiley ID 1136357