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3,6,12-Trimethyl-1,4,7,10,13,16-hexaazacyclooctadecane-2,5,8,11,14,17-hexone
SpectraBase Compound ID LYUuzWS7a2o
InChI InChI=1S/C15H24N6O6/c1-7-13(25)18-6-12(24)20-9(3)15(27)21-8(2)14(26)17-4-10(22)16-5-11(23)19-7/h7-9H,4-6H2,1-3H3,(H,16,22)(H,17,26)(H,18,25)(H,19,23)(H,20,24)(H,21,27)
InChIKey ODQIENVYMPDQQD-UHFFFAOYSA-N
Mol Weight 384.39 g/mol
Molecular Formula C15H24N6O6
Exact Mass 384.175733 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4ef7IJY6Jk
Name 3,6,12-Trimethyl-1,4,7,10,13,16-hexaazacyclooctadecane-2,5,8,11,14,17-hexone
CAS Registry Number 5519-72-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H24N6O6
InChI InChI=1S/C15H24N6O6/c1-7-13(25)18-6-12(24)20-9(3)15(27)21-8(2)14(26)17-4-10(22)16-5-11(23)19-7/h7-9H,4-6H2,1-3H3,(H,16,22)(H,17,26)(H,18,25)(H,19,23)(H,20,24)(H,21,27)
InChIKey ODQIENVYMPDQQD-UHFFFAOYSA-N
Molecular Weight 384.393 g/mol
SMILES N1C(C(=O)NCC(NCC(=O)NC(C(=O)NCC(NC(C)C1=O)=O)C)=O)C
SPLASH splash10-052f-9300000000-009aaf7acef9347e87dc
Synonyms 3,6,12-Trimethyl-1,4,7,10,13,16-hexaaza-cyclooctadecane-2,5,8,11,14,17-hexaone 3,6,12-trimethyl-1,4,7,10,13,16-hexazacyclooctadecane-2,5,8,11,14,17-hexone 3,6,12-trimethyl-1,4,7,10,13,16-hexazacyclooctadecane-2,5,8,11,14,17-triquinone
Wiley ID 1484743