SpectraBase Spectrum ID |
CdbsLkTNhoD |
Name |
2-Naphthalenecarboxylic acid, 1,2,3,4-tetrahydro-3-methyl-1-phenyl-4-[(phenylmethyl)thio]-, methyl ester, (1.alpha.,2.beta.,3.alpha.,4.al pha.)- |
CAS Registry Number |
112395-93-4 |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C26H26O2S |
InChI |
InChI=1S/C26H26O2S/c1-18-23(26(27)28-2)24(20-13-7-4-8-14-20)21-15-9-10-16-22(21)25(18)29-17-19-11-5-3-6-12-19/h3-16,18,23-25H,17H2,1-2H3/t18-,23-,24-,25-/m0/s1 |
InChIKey |
UYMJATBBKJFJAQ-MGKKLRQFSA-N |
Molecular Weight |
402.552 g/mol |
SMILES |
[C@@]1([C@](c2ccccc2[C@]([C@]1(C)[H])(SCc1ccccc1)[H])(c1ccccc1)[H])(C(=O)OC)[H] |
SPLASH |
splash10-014i-2094000000-2cce3825e88fbeda05e8 |
Source of Spectrum |
I-65-486-25 |
Synonyms |
1-(benzylthio)-2-methyl-3-(methoxycarbonyl)-4-phenyl-1,2,3,4-dihydro-napthalene
Methyl (1S,2R,3S,4S)-4-(benzylsulfanyl)-3-methyl-1-phenyl-1,2,3,4-tetrahydro-2-naphthalenecarboxylate |
Wiley ID |
1370596 |