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1-(4'-BROMOBUTYL)-2,14-DIOXO-1-AZACYCLOTETRADECANE-3-CARBONITRILE
SpectraBase Compound ID 82MHpKRlc4s
InChI InChI=1S/C18H29BrN2O2/c19-13-9-10-14-21-17(22)12-8-6-4-2-1-3-5-7-11-16(15-20)18(21)23/h16H,1-14H2
InChIKey QQRWBKVFBLGFEV-UHFFFAOYSA-N
Mol Weight 385.35 g/mol
Molecular Formula C18H29BrN2O2
Exact Mass 384.141241 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Jyy4kBd4TYj
Name 1-(4-bromanylbutyl)-2,14-bis(oxidanylidene)-1-azacyclotetradecane-3-carbonitrile
Alternate Name(s) 1-(4-bromobutyl)-2,14-diketo-azacyclotetradecane-3-carbonitrile 1-(4-bromobutyl)-2,14-dioxo-azacyclotetradecane-3-carbonitrile
CAS Registry Number 128853-83-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H29BrN2O2
InChI InChI=1S/C18H29BrN2O2/c19-13-9-10-14-21-17(22)12-8-6-4-2-1-3-5-7-11-16(15-20)18(21)23/h16H,1-14H2
InChIKey QQRWBKVFBLGFEV-UHFFFAOYSA-N
Molecular Weight 385.346 g/mol
SMILES C1(N(C(CCCCCCCCCCC1C#N)=O)CCCCBr)=O
SPLASH splash10-0a4m-9101000000-9f03c820754839e5aa3f
Source of Spectrum H-73-275-9
Wiley ID 1361389