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2-Butenoic acid, 4-[(1-iodo-2-naphthalenyl)oxy]-, ethyl ester
SpectraBase Compound ID HOb8CZqw6Bc
InChI InChI=1S/C16H15IO3/c1-2-19-15(18)8-5-11-20-14-10-9-12-6-3-4-7-13(12)16(14)17/h3-10H,2,11H2,1H3/b8-5+
InChIKey GDTDSEGVKWBWAQ-VMPITWQZSA-N
Mol Weight 382.2 g/mol
Molecular Formula C16H15IO3
Exact Mass 382.006589 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2h6v9mv7bFd
Name 2-Butenoic acid, 4-[(1-iodo-2-naphthalenyl)oxy]-, ethyl ester
Alternate Name(s) Ethyl (2E)-4-[(1-iodo-2-naphthyl)oxy]-2-butenoate Ethyl-4-(1'-iodo)-2'-naphthylbutanoate
CAS Registry Number 111726-54-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H15IO3
InChI InChI=1S/C16H15IO3/c1-2-19-15(18)8-5-11-20-14-10-9-12-6-3-4-7-13(12)16(14)17/h3-10H,2,11H2,1H3/b8-5+
InChIKey GDTDSEGVKWBWAQ-VMPITWQZSA-N
Molecular Weight 382.197 g/mol
SMILES c1(c2c(cccc2)ccc1OC\C=C\C(=O)OCC)I
SPLASH splash10-00l6-0956000000-61a20487fd5f70878daa
Source of Spectrum I-65-2022-8
Wiley ID 1360372