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2-((3,4-Dihydronaphthalen-1(2H)-ylidene)hydrazono)-5-(furan-2-yl)-3-(4-nitrophenyl)-2,3-dihydro-1,3,4-thiadiazole
SpectraBase Compound ID 2AIbtg3lhB5
InChI InChI=1S/C22H17N5O3S/c28-27(29)17-12-10-16(11-13-17)26-22(31-21(25-26)20-9-4-14-30-20)24-23-19-8-3-6-15-5-1-2-7-18(15)19/h1-2,4-5,7,9-14H,3,6,8H2
InChIKey ONBCVEPPLRGPAC-UHFFFAOYSA-N
Mol Weight 431.47 g/mol
Molecular Formula C22H17N5O3S
Exact Mass 431.105211 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3mkj1lHsI3F
Name 2-((3,4-Dihydronaphthalen-1(2H)-ylidene)hydrazono)-5-(furan-2-yl)-3-(4-nitrophenyl)-2,3-dihydro-1,3,4-thiadiazole
Appearance Orange crystals
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Exact Mass 431.105210598 u
Formula C22H17N5O3S
InChI InChI=1S/C22H17N5O3S/c28-27(29)17-12-10-16(11-13-17)26-22(31-21(25-26)20-9-4-14-30-20)24-23-19-8-3-6-15-5-1-2-7-18(15)19/h1-2,4-5,7,9-14H,3,6,8H2
InChIKey ONBCVEPPLRGPAC-UHFFFAOYSA-N
Instrument Name Shimadzu GCMS-QP-1000 EX
Ionization Type EI
Literature Reference DOI 10.1002/jhet.4611
Molecular Weight 431.470 g/mol
Quality 6
SMILES C12=C(C=CC=C2)C(CCC1)=NN=C1SC(=NN1C1=CC=C(C=C1)[N+](=O)[O-])C=1OC=CC1
SPLASH splash10-004i-0900000000-73ec60ea1131e1a25937
Source of Spectrum Y-60-592-16 (DOI: 10.1002/jhet.4611)
Wiley ID 1894529