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2,7-Diaminoheptanoic acid methyl ester
SpectraBase Compound ID CGEENlexCgb
InChI InChI=1S/C8H18N2O2/c1-12-8(11)7(10)5-3-2-4-6-9/h7H,2-6,9-10H2,1H3
InChIKey SGIVSYZIYSEDKA-UHFFFAOYSA-N
Mol Weight 174.24 g/mol
Molecular Formula C8H18N2O2
Exact Mass 174.136828 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HWPwsp8hXtO
Name 2,7-Diaminoheptanoic acid methyl ester
Alternate Name(s) Methyl 2,7-diaminoheptanoate Methyl 2,7-bis(azanyl)heptanoate
CAS Registry Number 63273-39-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H18N2O2
InChI InChI=1S/C8H18N2O2/c1-12-8(11)7(10)5-3-2-4-6-9/h7H,2-6,9-10H2,1H3
InChIKey SGIVSYZIYSEDKA-UHFFFAOYSA-N
Molecular Weight 174.244 g/mol
SMILES NC(CCCCCN)C(=O)OC
SPLASH splash10-001a-9000000000-eb2439a0166ae99f2c86
Source of Spectrum H-60-390-0
Wiley ID 1170409