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6-Iodo-3,4-di-n-propylisoquinolin-1(2H)-one
SpectraBase Compound ID IHUmvO59XCp
InChI InChI=1S/C15H18INO/c1-3-5-11-13-9-10(16)7-8-12(13)15(18)17-14(11)6-4-2/h7-9H,3-6H2,1-2H3,(H,17,18)
InChIKey OTFMFSPMDMLCMQ-UHFFFAOYSA-N
Mol Weight 355.22 g/mol
Molecular Formula C15H18INO
Exact Mass 355.043309 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GS8EKq3DYn4
Name 6-Iodo-3,4-di-n-propylisoquinolin-1(2H)-one
Alternate Name(s) 6-Iodo-3,4-dipropylisoquinolin-1(2H)-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H18INO
InChI InChI=1S/C15H18INO/c1-3-5-11-13-9-10(16)7-8-12(13)15(18)17-14(11)6-4-2/h7-9H,3-6H2,1-2H3,(H,17,18)
InChIKey OTFMFSPMDMLCMQ-UHFFFAOYSA-N
Literature Reference DOI 10.1021/jo501884v
Molecular Weight 355.219 g/mol
SMILES N1C(=C(c2cc(ccc2C1=O)I)CCC)CCC
SPLASH splash10-004i-0109000000-bc765ecd49937a947b2b
Source of Spectrum J-79-12079-5ga
Wiley ID 1755643