Debug Info

object
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_id
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Lc12znpxxLL
spectrumID
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Lc12znpxxLL
cost
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1
specType
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131072
xnmrNucleus
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dbLocation
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WMS3X:77955:1
hasStructureAssignments
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properties
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analyticalTechnique
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MS (GC)
analyticalTechniqueLongName
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Mass Spectrum (GC)
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spectralOutlier
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compound
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1735074081058
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2-Amino-6-chloro-benzoic acid
SpectraBase Compound ID CMthrSq6vBI
InChI InChI=1S/C7H6ClNO2/c8-4-2-1-3-5(9)6(4)7(10)11/h1-3H,9H2,(H,10,11)
InChIKey SZCPTRGBOVXVCA-UHFFFAOYSA-N
Mol Weight 171.58 g/mol
Molecular Formula C7H6ClNO2
Exact Mass 171.008706 g/mol
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Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Lc12znpxxLL
Name 2-Amino-6-chlorobenzoic acid
CAS Registry Number 2148-56-3
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H6ClNO2
InChI InChI=1S/C7H6ClNO2/c8-4-2-1-3-5(9)6(4)7(10)11/h1-3H,9H2,(H,10,11)
InChIKey SZCPTRGBOVXVCA-UHFFFAOYSA-N
Molecular Weight 171.583 g/mol
SMILES OC(c1c(cccc1Cl)N)=O
SPLASH splash10-0fmi-0900000000-b11f15d6142ac13d0606
Source of Spectrum CJ-1992-0-0
Synonyms 2-Amino-6-chloro-benzoic acid 2-Azanyl-6-chloranyl-benzoic acid Benzoic acid, 2-amino-6-chloro-
Wiley ID 1167768
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