Debug Info

object
{15}
_id
:
LMSG3fOF2mR
spectrumID
:
LMSG3fOF2mR
cost
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1
specType
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4096
xnmrNucleus
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0
dbLocation
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SAX:58867:17997457155295499252
hasStructureAssignments
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false
properties
{10}
analyticalTechnique
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FTIR
analyticalTechniqueLongName
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Transmission Infrared (IR) Spectrum
isFullSpectrum
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true
spectralOutlier
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false
compound
{10}
lastUpdated
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1735074081058
isDeprecated
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false

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4-carbamoyl-1-(carboxymethyl)pyridinium chloride, dodecyl ester
SpectraBase Compound ID K4xhI2lWlcc
InChI InChI=1S/C20H32N2O3.ClH/c1-2-3-4-5-6-7-8-9-10-11-16-25-19(23)17-22-14-12-18(13-15-22)20(21)24;/h12-15H,2-11,16-17H2,1H3,(H-,21,24);1H
InChIKey ZVDNNNCLPGFXEL-UHFFFAOYSA-N
Mol Weight 384.95 g/mol
Molecular Formula C20H33ClN2O3
Exact Mass 384.217971 g/mol
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Transmission Infrared (IR) Spectrum

Transmission Infrared (IR) Spectrum

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SpectraBase Spectrum ID LMSG3fOF2mR
Name 4-CARBAMOYL-1-(CARBOXYMETHYL)PYRIDINIUM CHLORIDE, DODECYL ESTER
Source of Sample Aldrich Chemical Company, Inc., Milwaukee, Wisconsin
Catalog Number S40401
Copyright Copyright © 1980, 1981-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H33ClN2O3
InChI InChI=1S/C20H32N2O3.ClH/c1-2-3-4-5-6-7-8-9-10-11-16-25-19(23)17-22-14-12-18(13-15-22)20(21)24;/h12-15H,2-11,16-17H2,1H3,(H-,21,24);1H
InChIKey ZVDNNNCLPGFXEL-UHFFFAOYSA-N
Molecular Weight 384.945007
Synonyms PYRIDINIUM CHLORIDE, 4-CARBAMOYL- 1-/CARBOXYMETHYL/-, DODECYL ESTER
Technique FILM (CAST FROM CHCl3)
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