Debug Info

object
{15}
_id
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KDC0wLqk1Tz
spectrumID
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KDC0wLqk1Tz
cost
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specType
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131072
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dbLocation
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properties
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analyticalTechnique
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Mass Spectrum (GC)
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spectralOutlier
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compound
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Methyl 2,3,3A.beta.,4,5,7alpha.-hexahydroindene-4-.beta.-carboxylate
SpectraBase Compound ID GDGjiOt2AXd
InChI InChI=1S/C11H16O2/c1-13-11(12)10-7-3-5-8-4-2-6-9(8)10/h3,5,8-10H,2,4,6-7H2,1H3/t8-,9+,10+/m0/s1
InChIKey DRCBJOYOGDOCNF-IVZWLZJFSA-N
Mol Weight 180.25 g/mol
Molecular Formula C11H16O2
Exact Mass 180.11503 g/mol
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Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KDC0wLqk1Tz
Name Methyl 2,3,3a.beta.,4,5,7alpha.-Hexahydroindene-4-.beta.-carboxylate
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H16O2
InChI InChI=1S/C11H16O2/c1-13-11(12)10-7-3-5-8-4-2-6-9(8)10/h3,5,8-10H,2,4,6-7H2,1H3/t8-,9+,10+/m0/s1
InChIKey DRCBJOYOGDOCNF-IVZWLZJFSA-N
Molecular Weight 180.247 g/mol
SMILES [C@@]1(C(=O)OC)([C@]2([C@](CCC2)([H])C=CC1)[H])[H]
SPLASH splash10-00fv-8900000000-188d5ecbd23aaae9b363
Source of Spectrum J-58-2392-6
Synonyms Methyl (3aR,4R,7aS)-2,3,3a,4,5,7a-hexahydro-1H-indene-4-carboxylate
Wiley ID 1176654
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