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4,8-Etheno-3a,8a-methano-4H-1,3-dithiolo[4,5-f]isoindole-5,7(4aH,6H)-dione, 7a,8-dihydro-6-phenyl-
SpectraBase Compound ID AsLsqEgwHce
InChI InChI=1S/C18H15NO2S2/c20-15-13-11-6-7-12(18-8-17(11,18)22-9-23-18)14(13)16(21)19(15)10-4-2-1-3-5-10/h1-7,11-14H,8-9H2
InChIKey KPMMLPWGSARHKI-UHFFFAOYSA-N
Mol Weight 341.44 g/mol
Molecular Formula C18H15NO2S2
Exact Mass 341.054421 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID H19WJYPVAQM
Name 4,8-Etheno-3a,8a-methano-4H-1,3-dithiolo[4,5-f]isoindole-5,7(4aH,6H)-dione, 7a,8-dihydro-6-phenyl-
CAS Registry Number 94042-21-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H15NO2S2
InChI InChI=1S/C18H15NO2S2/c20-15-13-11-6-7-12(18-8-17(11,18)22-9-23-18)14(13)16(21)19(15)10-4-2-1-3-5-10/h1-7,11-14H,8-9H2
InChIKey KPMMLPWGSARHKI-UHFFFAOYSA-N
Molecular Weight 341.443 g/mol
SMILES C123C(C4C5C(=O)N(C(C5C1C=C4)=O)c1ccccc1)(SCS3)C2
SPLASH splash10-0gbi-0900000000-b65579ee90015c93f8e3
Source of Spectrum J-50-184-18
Synonyms 10-phenyl-3,5-dithia-10-azapentacyclo[5.5.2.1(2,6).0(2,6).0(8,12)]pentadec-13-ene-9,11-dione 4-Aza-9,11-dithia-4-phenyl-tertracyclo[5.5.2.0(2,6).0(8,12)]tetradecan-13-ene-3,5-dione
Wiley ID 1335840