For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
guanidinosuccinate, 2TMS, 1MEOX
SpectraBase Compound ID BdWgxOnuCgF
InChI InChI=1S/C5H9N3O4/c6-5(7)8-2(4(11)12)1-3(9)10/h2H,1H2,(H,9,10)(H,11,12)(H4,6,7,8)
InChIKey VVHOUVWJCQOYGG-UHFFFAOYSA-N
Mol Weight 175.14 g/mol
Molecular Formula C5H9N3O4
Exact Mass 175.059306 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 5kISIDRXoJz
Name guanidinosuccinate, 4TMS
Comments Non-derivatized structure shown; Derivatization type: 4 TMS (mass: 463.217); CC-BY: Oliver Fiehn, University of California, Davis; MoNA-ID: FiehnLib001001; Note: The molecular formula of the structure shown is C5H9N3O4 - which differs from the formula reported for the mass spectrum (C17H41N3O4Si4)
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H41N3O4Si4
InChI InChI=1S/C5H9N3O4/c6-5(7)8-2(4(11)12)1-3(9)10/h2H,1H2,(H,9,10)(H,11,12)(H4,6,7,8)
InChIKey VVHOUVWJCQOYGG-UHFFFAOYSA-N
Molecular Weight 175.144 g/mol
SMILES OC(C(CC(=O)O)NC(=N)N)=O
SPLASH splash10-0fdk-0911200000-ace20d93e890956582eb
Source of Spectrum FM-2019-1001-0
Synonyms Guanidinosuccinic acid, 4TMS L-N-Amidinoaspartic acid, 4TMS N-Amidino-L-aspartic acid, 4TMS G7379_SIGMA, 4TMS Aspartic acid, N-amidino- (7CI), 4TMS NSC49078, 4TMS 2-(diaminomethylideneamino)butanedioic acid, 4TMS Carbamimidoylaspartic acid
Wiley ID 1818661