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2-(N,N,N-Trimethylamino)-7-(methoxycarbonyl)-6-aminoheptanoate - Internal Salt

View entire compound with spectra: 1 MS (GC)

2-(N,N,N-Trimethylamino)-7-(methoxycarbonyl)-6-aminoheptanoate - Internal Salt
SpectraBase Compound ID EAvYr0A0ts2
InChI InChI=1S/C11H22N2O4/c1-13(2,3)9(10(14)15)7-5-6-8(12)11(16)17-4/h8-9H,5-7,12H2,1-4H3
InChIKey HRAGFHZXOMQALZ-UHFFFAOYSA-N
Mol Weight 246.31 g/mol
Molecular Formula C11H22N2O4
Exact Mass 246.157957 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 55qPw6fXWez
Name 2-(N,N,N-Trimethylamino)-7-(methoxycarbonyl)-6-aminoheptanoate - Internal Salt
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H22N2O4
InChI InChI=1S/C11H22N2O4/c1-13(2,3)9(10(14)15)7-5-6-8(12)11(16)17-4/h8-9H,5-7,12H2,1-4H3
InChIKey HRAGFHZXOMQALZ-UHFFFAOYSA-N
Molecular Weight 246.307 g/mol
SMILES NC(C(=O)OC)CCCC([N+](C)(C)C)C([O-])=O
SPLASH splash10-052f-9200000000-c022c7704f3f42e7ecd8
Source of Spectrum X2-48-604-2
Wiley ID 1601728