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(E)-4-[1-(2-phthalimidoethenyl)]phencyclidine
SpectraBase Compound ID HiAO9rcA8Ua
InChI InChI=1S/C27H30N2O2/c1-20(29-25(30)23-12-6-7-13-24(23)26(29)31)21-14-18-28(19-15-21)27(16-8-3-9-17-27)22-10-4-2-5-11-22/h2,4-7,10-13,21H,1,3,8-9,14-19H2
InChIKey YVPNHCZJBKEODM-UHFFFAOYSA-N
Mol Weight 414.55 g/mol
Molecular Formula C27H30N2O2
Exact Mass 414.230728 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 80XqfcfIJ3C
Name (E)-4-[1-(2-phthalimidoethenyl)]phencyclidine
Alternate Name(s) 2-{1-[1-(1-phenylcyclohexyl)-4-piperidinyl]vinyl}-1H-isoindole-1,3(2H)-dione
CAS Registry Number 77415-82-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C27H30N2O2
InChI InChI=1S/C27H30N2O2/c1-20(29-25(30)23-12-6-7-13-24(23)26(29)31)21-14-18-28(19-15-21)27(16-8-3-9-17-27)22-10-4-2-5-11-22/h2,4-7,10-13,21H,1,3,8-9,14-19H2
InChIKey YVPNHCZJBKEODM-UHFFFAOYSA-N
Molecular Weight 414.549 g/mol
SMILES C1(N(C(c2ccccc12)=O)C(C1CCN(CC1)C1(c2ccccc2)CCCCC1)=C)=O
SPLASH splash10-03di-0029500000-41cae09d6faedf5696fd
Source of Spectrum J-46-2769-0
Wiley ID 1375650