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(E,S)-2-heptensaeure, 4-amino-6-methyl-, methylester, hydrochlorid
SpectraBase Compound ID GWdQIFOaSdI
InChI InChI=1S/C9H17NO2.ClH/c1-7(2)6-8(10)4-5-9(11)12-3;/h4-5,7-8H,6,10H2,1-3H3;1H/b5-4+;
InChIKey ZRNKNWRBEMKPQH-FXRZFVDSSA-N
Mol Weight 207.7 g/mol
Molecular Formula C9H18ClNO2
Exact Mass 207.102607 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IlJE1U9b04Y
Name (E,S)-2-HEPTENOIC ACID, 4-AMINO-6-METHYL-, METHYL ESTER, HYDROCHLORIDE
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C9H18ClNO2
InChI InChI=1S/C9H17NO2.ClH/c1-7(2)6-8(10)4-5-9(11)12-3;/h4-5,7-8H,6,10H2,1-3H3;1H/b5-4+;
InChIKey ZRNKNWRBEMKPQH-FXRZFVDSSA-N
Instrument Name 311A
Molecular Weight 207.1022
SMILES Cl.NC(\C=C\C(OC)=O)CC(C)C
SPLASH splash10-03di-9700000000-b18beda5a69af51750b4
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany