2-Amino-4-(3-fluorophenyl)-1,5-dithiaspiro[5.5]undec-2-ene-3-carbonitrile

SpectraBase Compound ID	LwL8daUDy6q
InChI	InChI=1S/C16H17FN2S2/c17-12-6-4-5-11(9-12)14-13(10-18)15(19)21-16(20-14)7-2-1-3-8-16/h4-6,9,14H,1-3,7-8,19H2
InChIKey	QKMPJOQFAYOJHQ-UHFFFAOYSA-N Google Search
Mol Weight	320.44 g/mol
Molecular Formula	C16H17FN2S2
Exact Mass	320.081719 g/mol

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SpectraBase Spectrum ID	5S9ToRJC6aR
Name	2-Amino-4-(3-fluorophenyl)-1,5-dithiaspiro[5.5]undec-2-ene-3-carbonitrile
CAS Registry Number	94833-77-9
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C16H17FN2S2
InChI	InChI=1S/C16H17FN2S2/c17-12-6-4-5-11(9-12)14-13(10-18)15(19)21-16(20-14)7-2-1-3-8-16/h4-6,9,14H,1-3,7-8,19H2
InChIKey	QKMPJOQFAYOJHQ-UHFFFAOYSA-N
Molecular Weight	320.444 g/mol
SMILES	NC1=C(C(c2cc(F)ccc2)SC2(S1)CCCCC2)C#N
SPLASH	splash10-08gi-9530000000-73c3b537bac8fd36381d
Source of Spectrum	AD-0-2532-0
Synonyms	1,5-Dithiaspiro[5,5]undec-2-ene, 2-amino-3-cyano-4-(3-fluorophenyl)- 10-amino-8-(3-fluorophenyl)-7,11-dithiaspiro[5.5]undec-9-ene-9-carbonitrile 4-Azanyl-2-(3-fluorophenyl)-1,5-dithiaspiro[5.5]undec-3-ene-3-carbonitrile
Wiley ID	1422681