Debug Info

object
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_id
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7bh7Nh38oCX
spectrumID
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7bh7Nh38oCX
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specType
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dbLocation
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WMS3X:394361:1
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analyticalTechnique
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MS (GC)
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Mass Spectrum (GC)
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compound
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Dimethyl 8-Tolylbicyclo[3.3.0]octane-2,2-dicarboxylate
SpectraBase Compound ID KQ4wbUZ9nL
InChI InChI=1S/C19H24O4/c1-12-4-6-13(7-5-12)15-9-8-14-10-11-19(16(14)15,17(20)22-2)18(21)23-3/h4-7,14-16H,8-11H2,1-3H3/t14-,15-,16+/m0/s1
InChIKey HWXRJPAUEXTCDV-HRCADAONSA-N
Mol Weight 316.4 g/mol
Molecular Formula C19H24O4
Exact Mass 316.167459 g/mol
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Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7bh7Nh38oCX
Name Dimethyl 8-Tolylbicyclo[3.3.0]octane-2,2-dicarboxylate
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H24O4
InChI InChI=1S/C19H24O4/c1-12-4-6-13(7-5-12)15-9-8-14-10-11-19(16(14)15,17(20)22-2)18(21)23-3/h4-7,14-16H,8-11H2,1-3H3/t14-,15-,16+/m0/s1
InChIKey HWXRJPAUEXTCDV-HRCADAONSA-N
Molecular Weight 316.397 g/mol
SMILES C1([C@]2([C@@](CC[C@@]2([H])CC1)(c1ccc(cc1)C)[H])[H])(C(=O)OC)C(=O)OC
SPLASH splash10-0a4i-3901000000-f9b2534c7096a8e3a5cc
Source of Spectrum F-48-3900-9
Synonyms (3aS,6aR)-6-((R)-p-Tolyl)-hexahydro-pentalene-1,1-dicarboxylic acid dimethyl ester Dimethyl 6-(4-methylphenyl)hexahydro-1,1(2H)-pentalenedicarboxylate
Wiley ID 1316941
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