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6,6-Bis[(4'S)-4'-isopropylthiazolin-2'-yl]dibenzo[a,c]cyclohepta-1,3-diene

View entire compound with spectra: 1 MS (GC)

6,6-Bis[(4'S)-4'-isopropylthiazolin-2'-yl]dibenzo[a,c]cyclohepta-1,3-diene
SpectraBase Compound ID 4S2PY7LdKwx
InChI InChI=1S/C27H32N2S2/c1-17(2)23-15-30-25(28-23)27(26-29-24(16-31-26)18(3)4)13-19-9-5-7-11-21(19)22-12-8-6-10-20(22)14-27/h5-12,17-18,23-24H,13-16H2,1-4H3/t23-,24-/m1/s1
InChIKey JVMGLCSFZHSECS-DNQXCXABSA-N
Mol Weight 448.7 g/mol
Molecular Formula C27H32N2S2
Exact Mass 448.200691 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID F6Udwzy6nHC
Name 6,6-Bis[(4'S)-4'-isopropylthiazolin-2'-yl]dibenzo[a,c]cyclohepta-1,3-diene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C27H32N2S2
InChI InChI=1S/C27H32N2S2/c1-17(2)23-15-30-25(28-23)27(26-29-24(16-31-26)18(3)4)13-19-9-5-7-11-21(19)22-12-8-6-10-20(22)14-27/h5-12,17-18,23-24H,13-16H2,1-4H3/t23-,24-/m1/s1
InChIKey JVMGLCSFZHSECS-DNQXCXABSA-N
Molecular Weight 448.687 g/mol
SMILES C1(C2=N[C@@](C(C)C)(CS2)[H])(C2=N[C@@](C(C)C)(CS2)[H])Cc2c(cccc2)-c2c(C1)cccc2
SPLASH splash10-00fr-0079700000-5cfb2f26fcf0ca0b012f
Source of Spectrum C5-2004-224-1
Synonyms (4S)-4-isopropyl-2-{6-[(4S)-4-isopropyl-4,5-dihydro-1,3-thiazol-2-yl]-6,7-dihydro-5H-dibenzo[a,c]cyclohepten-6-yl}-4,5-dihydro-1,3-thiazole 6,6'-Bis[(4'S)-4'-isopropylthiazolin-2'-yl]dibenzo[a,c]cyclohepta-1,3-diene
Wiley ID 1616476