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3-[12'-Ethenyl- 9',10'-dihydro-9',10'-ethanoanthracene-11'-ylidene]prop-2-enoyl chloride
SpectraBase Compound ID JJm8ca9gmHj
InChI InChI=1S/C21H15ClO/c1-2-13-18(11-12-19(22)23)21-16-9-5-3-7-14(16)20(13)15-8-4-6-10-17(15)21/h2-10,12-13,20-21H,1H2/t11?,13-,20-,21+/m0/s1
InChIKey PTQUNXZYTBDZAD-WAYYXFLXSA-N
Mol Weight 318.8 g/mol
Molecular Formula C21H15ClO
Exact Mass 318.081143 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7B2NG1yZkLO
Name 3-[12'-Ethenyl- 9',10'-dihydro-9',10'-ethanoanthracene-11'-ylidene]prop-2-enoyl chloride
Alternate Name(s) 3-(12'-Ethenyl-9',10'-dihydro-9',10'-ethanoanthracene-11'-ylidene)prop-2-enoyl chloride 3-(16-vinyltetracyclo[6.6.2.0(2,7).0(9,14)]hexadeca-2,4,6,9,11,13-hexaen-15-ylidene)acryloyl chloride
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H15ClO
InChI InChI=1S/C21H15ClO/c1-2-13-18(11-12-19(22)23)21-16-9-5-3-7-14(16)20(13)15-8-4-6-10-17(15)21/h2-10,12-13,20-21H,1H2/t11?,13-,20-,21+/m0/s1
InChIKey PTQUNXZYTBDZAD-WAYYXFLXSA-N
Molecular Weight 318.803 g/mol
SMILES C1([C@]2(c3ccccc3[C@@]([C@]1(C=C)[H])(c1ccccc21)[H])[H])=C=CC(=O)Cl
SPLASH splash10-004i-0900000000-df47d3f11e3df98ce131
Source of Spectrum B-52-671-26
Wiley ID 746496