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2-(E)-Heptensaeure, (4S)-4-[((R)-alanyl)amino]-6-methyl-, ethylester, hydrochlor
SpectraBase Compound ID BBIRu0eJlfF
InChI InChI=1S/C13H24N2O3.Cl/c1-5-18-12(16)7-6-11(8-9(2)3)15-13(17)10(4)14;/h6-7,9-11H,5,8,14H2,1-4H3,(H,15,17);/b7-6+;
InChIKey ZFSLGZPXFZUQDX-UHDJGPCESA-N
Mol Weight 291.8 g/mol
Molecular Formula C13H24ClN2O3
Exact Mass 291.147545 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HscrX06I2TF
Name 2-(E)-Heptensaeure, (4S)-4-[((R)-alanyl)amino]-6-methyl-, ethylester, hydrochlor
Alternate Name(s) 2-(E)-Heptensaeure, (4S)-4-[((S)-alanyl)amino]-6-methyl-, ethylester, hydrochlor 2-(E)-Heptensaeure, (4S)-4-[((R)-alanyl)amino]-6-methyl-, ethylester, hydrochlorid (D-ala-L-DHSOET.HCL) 2-(E)-Heptensaeure, (4S)-4-[((S)-alanyl)amino]-6-methyl-, ethylester, hydrochlorid (L-ala-L-DHSOET.HCL) Ethyl (2E)-4-[(2-aminopropanoyl)amino]-6-methyl-2-heptenoate hydrochloride Ethyl 4-[(2-aminopropanoyl)amino]-6-methyl-2-heptenoate hydrochloride
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Formula C13H25ClN2O3
InChI InChI=1S/C13H24N2O3.Cl/c1-5-18-12(16)7-6-11(8-9(2)3)15-13(17)10(4)14;/h6-7,9-11H,5,8,14H2,1-4H3,(H,15,17);/b7-6+;
InChIKey ZFSLGZPXFZUQDX-UHDJGPCESA-N
Molecular Weight 292.807 g/mol
SMILES Cl.N(C(\C=C\C(OCC)=O)CC(C)C)C(C(C)N)=O
SPLASH splash10-0006-9100000000-8112bec06fc49ce5c5b9
Wiley ID 1492961