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Spiro[naphthalene-2(1H),3'-[3H]pyrrol]-1-one, 2',3,4,4'-tetrahydro-4'-(methylthio)-2',5'-diphenyl-, cis-
SpectraBase Compound ID KMi7cvw1pI2
InChI InChI=1S/C26H23NOS/c1-29-25-22(19-11-4-2-5-12-19)27-23(20-13-6-3-7-14-20)26(25)17-16-18-10-8-9-15-21(18)24(26)28/h2-15,23,25H,16-17H2,1H3/t23-,25?,26+/m0/s1
InChIKey UJDGKFORLWCVGW-VCYMZNSASA-N
Mol Weight 397.54 g/mol
Molecular Formula C26H23NOS
Exact Mass 397.150036 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GL06zDRgpPh
Name Spiro[naphthalene-2(1H),3'-[3H]pyrrol]-1-one, 2',3,4,4'-tetrahydro-4'-(methylthio)-2',5'-diphenyl-, cis-
Alternate Name(s) (2R,2'S)-4'-(methylsulfanyl)-2',5'-diphenyl-2',4',3,4-tetrahydro-1H-spiro[naphthalene-2,3'-pyrrole]-1-one Spiro[(3,4-dihydronaphthalene-1-oxo)-2(1H),3'-(2',5'-diphenyl-4'-methyl-thio-5'-pyrroline)]
CAS Registry Number 132058-89-0
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C26H23NOS
InChI InChI=1S/C26H23NOS/c1-29-25-22(19-11-4-2-5-12-19)27-23(20-13-6-3-7-14-20)26(25)17-16-18-10-8-9-15-21(18)24(26)28/h2-15,23,25H,16-17H2,1H3/t23-,25?,26+/m0/s1
InChIKey UJDGKFORLWCVGW-VCYMZNSASA-N
Molecular Weight 397.536 g/mol
SMILES [C@@]12(C(c3ccccc3CC2)=O)[C@@](N=C(C1SC)c1ccccc1)(c1ccccc1)[H]
SPLASH splash10-0udi-0009000000-f157e79a249c94db6137
Source of Spectrum F-46-6779-8
Wiley ID 1368073