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2,11-dithia-19,20-diaza[12.2]metacyclophan-19-ene
SpectraBase Compound ID AzWCEHfC1Sq
InChI InChI=1S/C22H28N2S2/c1-2-4-6-14-26-18-20-10-8-12-22(16-20)24-23-21-11-7-9-19(15-21)17-25-13-5-3-1/h7-12,15-16H,1-6,13-14,17-18H2/b24-23-
InChIKey RIKIKTWZAIJYKB-VHXPQNKSSA-N
Mol Weight 384.6 g/mol
Molecular Formula C22H28N2S2
Exact Mass 384.169391 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID txGQlfunep
Name 2,11-dithia-19,20-diaza[12.2]metacyclophan-19-ene
CAS Registry Number 121012-99-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H28N2S2
InChI InChI=1S/C22H28N2S2/c1-2-4-6-14-26-18-20-10-8-12-22(16-20)24-23-21-11-7-9-19(15-21)17-25-13-5-3-1/h7-12,15-16H,1-6,13-14,17-18H2/b24-23-
InChIKey RIKIKTWZAIJYKB-VHXPQNKSSA-N
Molecular Weight 384.600 g/mol
SMILES c12\N=N/c3cc(CSCCCCCCCCSCc(c2)ccc1)ccc3
SPLASH splash10-001i-7719000000-ba715f3adb5c94bdb1e7
Source of Spectrum K-122-1933-5
Synonyms 10,19-dithia-2,3-diazatricyclo[19.3.1.1(4,8)]hexacosa-1(25),2,4(26),5,7,21,23-heptaene
Wiley ID 1361697