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3a,4,7,7a-tetrahydro-4,7-methanoindene-1-one
SpectraBase Compound ID JtNRoqClllb
InChI InChI=1S/C10H10O/c11-9-4-3-8-6-1-2-7(5-6)10(8)9/h1-4,6-8,10H,5H2/t6-,7+,8+,10-/m1/s1
InChIKey USCIQHADNYEBHX-CHIQAWFVSA-N
Mol Weight 146.19 g/mol
Molecular Formula C10H10O
Exact Mass 146.073165 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8J6nC0ZMptj
Name 3a,4,7,7a-tetrahydro-4,7-methanoindene-1-one
CAS Registry Number 5530-96-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H10O
InChI InChI=1S/C10H10O/c11-9-4-3-8-6-1-2-7(5-6)10(8)9/h1-4,6-8,10H,5H2/t6-,7+,8+,10-/m1/s1
InChIKey USCIQHADNYEBHX-CHIQAWFVSA-N
Molecular Weight 146.189 g/mol
SMILES [C@]12([C@@]3([C@@](C=CC3=O)([C@@](C1)(C=C2)[H])[H])[H])[H]
SPLASH splash10-014i-9800000000-4f195d10baf2843b09a2
Source of Spectrum KO-22-582-0
Synonyms (3Aalpha,4alpha,7alpha,7aalpha)-3a,4,7,7a-tetrahydro-4,7-methanoinden-1-one Tricyclo[5.2.1.0(2,6)]deca-4,8-dien-3-one 4,7-Methano-1H-inden-1-one, 3a,4,7,7a-tetrahydro- 4,7-Methano-1H-inden-1-one, 3a,4,7,7a-tetrahydro-, (3a.alpha.,4.beta.,7.beta.,7a.alpha.)- 4,7-Methanoinden-1-one, 3a,4,7,7a-tetrahydro-, stereoisomer 4.beta.,7.beta.-methano-3a.alpha.,4,7,7a.alpha.-tetrahydroindenone
Wiley ID 747058