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2-[N-(Benzyloxycarbonyl)aminomethyl]buta-1,4-dioic acid
SpectraBase Compound ID Clkvmz4TwLJ
InChI InChI=1S/C13H15NO6/c15-11(16)6-10(12(17)18)7-14-13(19)20-8-9-4-2-1-3-5-9/h1-5,10H,6-8H2,(H,14,19)(H,15,16)(H,17,18)
InChIKey HUYOAMJOIPBORO-UHFFFAOYSA-N
Mol Weight 281.26 g/mol
Molecular Formula C13H15NO6
Exact Mass 281.089937 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4an4yz9fnJS
Name 2-[N-(Benzyloxycarbonyl)aminomethyl]buta-1,4-dioic acid
Alternate Name(s) 2-({[(benzyloxy)carbonyl]amino}methyl)succinic acid 2-(benzyloxycarbonylaminomethyl)butanedioic acid 2-(phenylmethoxycarbonylaminomethyl)butanedioic acid
Comments Less than 3 mono-isotopic peaks
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Formula C13H15NO6
InChI InChI=1S/C13H15NO6/c15-11(16)6-10(12(17)18)7-14-13(19)20-8-9-4-2-1-3-5-9/h1-5,10H,6-8H2,(H,14,19)(H,15,16)(H,17,18)
InChIKey HUYOAMJOIPBORO-UHFFFAOYSA-N
Molecular Weight 281.264 g/mol
SMILES OC(C(CNC(=O)OCc1ccccc1)CC(=O)O)=O
SPLASH splash10-0006-9010000000-26dab96e51c08c26aabc
Source of Spectrum AT-37-4280-5
Wiley ID 853547