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2-(E)-HEPTENOIC ACID, (4S)-4-[((S)-PHENYLALANYL)AMINO]-6-METHYL-, HYDROCHLORIDE (L-PHE-L-DHSOH.HCL)
SpectraBase Compound ID HUZJ9Q8fTPv
InChI InChI=1S/C17H24N2O3.ClH/c1-12(2)10-14(8-9-16(20)21)19-17(22)15(18)11-13-6-4-3-5-7-13;/h3-9,12,14-15H,10-11,18H2,1-2H3,(H,19,22)(H,20,21);1H/b9-8+;
InChIKey DMBDRLDYQHEOGH-HRNDJLQDSA-N
Mol Weight 340.85 g/mol
Molecular Formula C17H25ClN2O3
Exact Mass 340.15537 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2wDGH1DIjJr
Name 2-(E)-HEPTENOIC ACID, (4S)-4-[((S)-PHENYLALANYL)AMINO]-6-METHYL-, HYDROCHLORIDE (L-PHE-L-DHSOH.HCL)
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C17H25ClN2O3
InChI InChI=1S/C17H24N2O3.ClH/c1-12(2)10-14(8-9-16(20)21)19-17(22)15(18)11-13-6-4-3-5-7-13;/h3-9,12,14-15H,10-11,18H2,1-2H3,(H,19,22)(H,20,21);1H/b9-8+;
InChIKey DMBDRLDYQHEOGH-HRNDJLQDSA-N
Instrument Name 311A
Molecular Weight 340.1548
SMILES Cl.NC(C(=O)NC(\C=C\C(=O)O)CC(C)C)Cc1ccccc1
SPLASH splash10-00di-6920000000-ca38bafa0fa65b1ed445
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany