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Cystathionine
SpectraBase Compound ID IlZq6daMGyN
InChI InChI=1S/C7H14N2O4S/c8-4(6(10)11)1-2-14-3-5(9)7(12)13/h4-5H,1-3,8-9H2,(H,10,11)(H,12,13)
InChIKey ILRYLPWNYFXEMH-UHFFFAOYSA-N
Mol Weight 222.26 g/mol
Molecular Formula C7H14N2O4S
Exact Mass 222.067428 g/mol

Raman Spectrum

Raman Spectrum

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SpectraBase Spectrum ID Ed3s94Uyimm
Name Cystathionine
Source of Sample Sigma-Aldrich Company LLC
Catalog Number C3633
Lot Number 059K3782
CAS Registry Number 535-34-2
Cell Type NMR tube
Comments mixture of isomers
Compound Type Pure
Copyright Copyright © 2015-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H14N2O4S
InChI InChI=1S/C7H14N2O4S/c8-4(6(10)11)1-2-14-3-5(9)7(12)13/h4-5H,1-3,8-9H2,(H,10,11)(H,12,13)
InChIKey ILRYLPWNYFXEMH-UHFFFAOYSA-N
Raman Corrections Referenced to internal white light source; 180 degree backscatter
Raman Laser Power 597 mW
Raman Laser Source Nd:YAG
SMILES OC(C(CCSCC(C(O)=O)N)N)=O
Scans Performed 2112
Source of Spectrum Forensic Spectral Research
Technique FT-Raman