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L-Histidine, ethyl ester
SpectraBase Compound ID I9KiWVEHDBa
InChI InChI=1S/C8H13N3O2/c1-2-13-8(12)7(9)3-6-4-10-5-11-6/h4-5,7H,2-3,9H2,1H3,(H,10,11)
InChIKey ACHWEOLUTJAHLV-UHFFFAOYSA-N
Mol Weight 183.21 g/mol
Molecular Formula C8H13N3O2
Exact Mass 183.100777 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID G0lZjU4ggO3
Name L-Histidine, ethyl ester
Alternate Name(s) Ethyl 2-amino-3-(1H-imidazol-5-yl)propanoate 2-Amino-3-(1H-imidazol-5-yl)propanoic acid ethyl ester 2-Amino-3-(1H-imidazol-5-yl)propionic acid ethyl ester Ethyl 2-azanyl-3-(1H-imidazol-5-yl)propanoate Ethyl L-histidinate EINECS 231-446-6
CAS Registry Number 7555-06-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H13N3O2
InChI InChI=1S/C8H13N3O2/c1-2-13-8(12)7(9)3-6-4-10-5-11-6/h4-5,7H,2-3,9H2,1H3,(H,10,11)
InChIKey ACHWEOLUTJAHLV-UHFFFAOYSA-N
Molecular Weight 183.211 g/mol
SMILES [nH]1c(CC(C(=O)OCC)N)cnc1
SPLASH splash10-001i-9200000000-b4420faecfc93c26c6cc
Source of Spectrum W5-12848-0-0
Wiley ID 1179565