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1,5-Diacetyl-3,7-bis(3-chloropropanoyl)-1,3,5,7-tetraazocane
SpectraBase Compound ID G3ZqT6aJ8GX
InChI InChI=1S/C14H22Cl2N4O4/c1-11(21)17-7-19(13(23)3-5-15)9-18(12(2)22)10-20(8-17)14(24)4-6-16/h3-10H2,1-2H3
InChIKey ZHTQZYAOOMCQKS-UHFFFAOYSA-N
Mol Weight 381.26 g/mol
Molecular Formula C14H22Cl2N4O4
Exact Mass 380.101811 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 65J1hOadJAP
Name 1,5-Diacetyl-3,7-bis(3-chloropropanoyl)-1,3,5,7-tetraazocane
CAS Registry Number 92531-04-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H22Cl2N4O4
InChI InChI=1S/C14H22Cl2N4O4/c1-11(21)17-7-19(13(23)3-5-15)9-18(12(2)22)10-20(8-17)14(24)4-6-16/h3-10H2,1-2H3
InChIKey ZHTQZYAOOMCQKS-UHFFFAOYSA-N
Molecular Weight 381.260 g/mol
SMILES C(Cl)CC(N1CN(CN(CN(C1)C(=O)C)C(CCCl)=O)C(=O)C)=O
SPLASH splash10-0006-9300000000-faf15cb27a613ce748c8
Synonyms 1,5-Diacetyl-3,7-bis(3-chloropropionyl)-octahydro-1,3,5,7-tetraazocine 3-Chloranyl-1-[5-(3-chloranylpropanoyl)-3,7-diethanoyl-1,3,5,7-tetrazocan-1-yl]propan-1-one 3-Chloro-1-[3,7-diacetyl-5-(3-chloro-1-oxopropyl)-1,3,5,7-tetrazocan-1-yl]-1-propanone 3-Chloro-1-[3,7-diacetyl-5-(3-chloropropanoyl)-1,3,5,7-tetrazocan-1-yl]propan-1-one
Wiley ID 1467728