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(Z)-2,5-Dichloro-N-(2-S-[2.2]paracyclophanyl-2,3-dihydroquinazolin-4(1H)-ylidene)aniline
SpectraBase Compound ID 3BAGbDQBrrF
InChI InChI=1S/C30H25Cl2N3/c31-23-14-15-26(32)28(18-23)34-29-24-6-1-2-7-27(24)33-30(35-29)25-17-21-9-8-19-4-3-5-20(16-19)10-12-22(25)13-11-21/h1-7,11,13-18,30,33H,8-10,12H2,(H,34,35)/t30-/m0/s1
InChIKey RTEJPSHCLSAZAE-PMERELPUSA-N
Mol Weight 498.46 g/mol
Molecular Formula C30H25Cl2N3
Exact Mass 497.142553 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3SUjFrKaxcl
Name (Z)-2,5-Dichloro-N-(2-S-[2.2]paracyclophanyl-2,3-dihydroquinazolin-4(1H)-ylidene)aniline
Appearance White crystals
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C30H25Cl2N3
InChI InChI=1S/C30H25Cl2N3/c31-23-14-15-26(32)28(18-23)34-29-24-6-1-2-7-27(24)33-30(35-29)25-17-21-9-8-19-4-3-5-20(16-19)10-12-22(25)13-11-21/h1-7,11,13-18,30,33H,8-10,12H2,(H,34,35)/t30-/m0/s1
InChIKey RTEJPSHCLSAZAE-PMERELPUSA-N
Instrument Name Finnigan MAT 8430
Ionization Type EI
Literature Reference DOI 10.3998/ark.5550190.0010.a15
Molecular Weight 498.457 g/mol
SMILES N1[C@](c2c3CCc4cccc(CCc(cc3)c2)c4)(N\C(c2c1cccc2)=N/c1cc(ccc1Cl)Cl)[H]
SPLASH splash10-01pp-2287900000-a005f3a6143dc8c3ad8a
Source of Spectrum ARK-2009-155-3g
Wiley ID 1869599