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1H-Indole-3-propanoic acid, .alpha.-hydroxy-, methyl ester
SpectraBase Compound ID Gp9TD81hsZl
InChI InChI=1S/C12H13NO3/c1-16-12(15)11(14)6-8-7-13-10-5-3-2-4-9(8)10/h2-5,7,11,13-14H,6H2,1H3
InChIKey YHKXBTJWCNPFQV-UHFFFAOYSA-N
Mol Weight 219.24 g/mol
Molecular Formula C12H13NO3
Exact Mass 219.089543 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4fYqgfAFRw
Name Tryptophan-M ME
CAS Registry Number 18372-16-2
Classification Biomolecule
Comments Original RI info: ----
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Exact Mass 219.089543280 u
Formula C12H13NO3
InChI InChI=1S/C12H13NO3/c1-16-12(15)11(14)6-8-7-13-10-5-3-2-4-9(8)10/h2-5,7,11,13-14H,6H2,1H3
InChIKey YHKXBTJWCNPFQV-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 219.240 g/mol
SMILES c1(CC(O)C(=O)OC)c2ccccc2[nH]c1
SPLASH splash10-001i-1910000000-9aad54da106742d8b2aa
Sample Comments The MMPW Reference Handbook and associated Tables are attached to Record #1, under the Attachments tab. Refer to these references for an explanation of the Sample Preparation Procedure "Detected" abbreviations, as well as other relevant information pertaining to this database.
Source of Spectrum H.H.Maurer, M.Meyer, K.Pfleger, A.A. Weber / University of Saarland, D-66424 Homburg Germany
Synonyms Tryptophan-M (indole lactic acid) ME
Technique GC/MS
Wiley ID MMPW6e_1013