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4-(7,8,9,10-Tetrahydro-7,7,10,10-tetramethyl-4H-benzo[6,7]chromeno[4,3-d]thiazole-2-yl)benzoic acid

View entire compound with spectra: 1 MS (GC)

4-(7,8,9,10-Tetrahydro-7,7,10,10-tetramethyl-4H-benzo[6,7]chromeno[4,3-d]thiazole-2-yl)benzoic acid
SpectraBase Compound ID DKHBwj6U0QA
InChI InChI=1S/C25H25NO3S/c1-24(2)9-10-25(3,4)18-12-19-16(11-17(18)24)21-20(13-29-19)30-22(26-21)14-5-7-15(8-6-14)23(27)28/h5-8,11-12H,9-10,13H2,1-4H3,(H,27,28)
InChIKey RBVWTFPMVYCJOC-UHFFFAOYSA-N
Mol Weight 419.54 g/mol
Molecular Formula C25H25NO3S
Exact Mass 419.155515 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Iz39mgldCPX
Name 4-(7,8,9,10-Tetrahydro-7,7,10,10-tetramethyl-4H-benzo[6,7]chromeno[4,3-d]thiazole-2-yl)benzoic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H25NO3S
InChI InChI=1S/C25H25NO3S/c1-24(2)9-10-25(3,4)18-12-19-16(11-17(18)24)21-20(13-29-19)30-22(26-21)14-5-7-15(8-6-14)23(27)28/h5-8,11-12H,9-10,13H2,1-4H3,(H,27,28)
InChIKey RBVWTFPMVYCJOC-UHFFFAOYSA-N
Literature Reference DOI 10.1002/cjoc.201090325
Molecular Weight 419.539 g/mol
SMILES OC(c1ccc(cc1)-c1sc2c(n1)-c1cc3c(cc1OC2)C(CCC3(C)C)(C)C)=O
SPLASH splash10-0udi-0114900000-7678a28e3432e0dc968b
Source of Spectrum CJC-28-1955-10
Synonyms 4-(7,7,10,10-tetramethyl-7,8,9,10-tetrahydro-4H-benzo[6,7]chromeno[4,3-d]thiazol-2-yl)benzoic acid
Wiley ID 1772357