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(1-(2-azido-5-iodobenzoyl)cyclopropyl)(phenyl)methanone
SpectraBase Compound ID IaUUc1jP2pj
InChI InChI=1S/C17H12IN3O2/c18-12-6-7-14(20-21-19)13(10-12)16(23)17(8-9-17)15(22)11-4-2-1-3-5-11/h1-7,10H,8-9H2
InChIKey BEHSCCLODMYYSV-UHFFFAOYSA-N
Mol Weight 417.21 g/mol
Molecular Formula C17H12IN3O2
Exact Mass 416.997422 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LKQxf1SOYFB
Name (1-(2-azido-5-iodobenzoyl)cyclopropyl)(phenyl)methanone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H12IN3O2
InChI InChI=1S/C17H12IN3O2/c18-12-6-7-14(20-21-19)13(10-12)16(23)17(8-9-17)15(22)11-4-2-1-3-5-11/h1-7,10H,8-9H2
InChIKey BEHSCCLODMYYSV-UHFFFAOYSA-N
Literature Reference DOI 10.1021/ol400223d
Molecular Weight 417.206 g/mol
SMILES c1(C(C2(CC2)C(=O)c2c(ccc(c2)I)N=[N+]=[N-])=O)ccccc1
SPLASH splash10-0a6r-5912000000-2a7b18f2111b6c7f76c3
Source of Spectrum A1-15-1282/SM18-1c
Wiley ID 1748416