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(+)-Octopine
SpectraBase Compound ID BuUTHl6OjYo
InChI InChI=1S/C9H18N4O4/c1-5(7(14)15)13-6(8(16)17)3-2-4-12-9(10)11/h5-6,13H,2-4H2,1H3,(H,14,15)(H,16,17)(H4,10,11,12)/t5-,6+/m1/s1
InChIKey IMXSCCDUAFEIOE-RITPCOANSA-N
Mol Weight 246.27 g/mol
Molecular Formula C9H18N4O4
Exact Mass 246.132805 g/mol

Attenuated Total Reflectance Infrared (ATR-IR) Spectrum

Attenuated Total Reflectance Infrared (ATR-IR) Spectrum

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SpectraBase Spectrum ID AlZQGxF1aJ9
Name (+)-Octopine
Source of Sample Aldrich
Catalog Number 861928
CAS Registry Number 34522-32-2
Copyright Copyright © 2018-2024 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2018-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H18N4O4
InChI InChI=1S/C9H18N4O4/c1-5(7(14)15)13-6(8(16)17)3-2-4-12-9(10)11/h5-6,13H,2-4H2,1H3,(H,14,15)(H,16,17)(H4,10,11,12)/t5-,6+/m1/s1
InChIKey IMXSCCDUAFEIOE-RITPCOANSA-N
Purity 98%
Synonyms N2-(1-Carboxyethyl)-L-arginine N2-([R]-1-Carboxyethyl)-L-arginine
Wiley ID SIAL_ATR-IR_022200