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8-Thia-2-azatetracyclo[4.3.0.0(3,9).0(4,7)]nonane-5-0(endo)-carbonitrile
SpectraBase Compound ID DEBRy8QBKOp
InChI InChI=1S/C8H8N2S/c9-1-2-3-5-8-6(10-5)4(2)7(3)11-8/h2-8,10H/t2?,3-,4+,5-,6+,7?,8?
InChIKey BIGAAMOMUFCCFS-NTNHFBJWSA-N
Mol Weight 164.23 g/mol
Molecular Formula C8H8N2S
Exact Mass 164.040819 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1naUgtqacnM
Name 8-Thia-2-azatetracyclo[4.3.0.0(3,9).0(4,7)]nonane-5-0(endo)-carbonitrile
CAS Registry Number 122847-15-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H8N2S
InChI InChI=1S/C8H8N2S/c9-1-2-3-5-8-6(10-5)4(2)7(3)11-8/h2-8,10H/t2?,3-,4+,5-,6+,7?,8?
InChIKey BIGAAMOMUFCCFS-NTNHFBJWSA-N
Molecular Weight 164.226 g/mol
SMILES N1[C@@]2([C@]3(C([C@]4([C@]1(C2SC34)[H])[H])C#N)[H])[H]
SPLASH splash10-001i-9100000000-12182205087c7b5ef214
Source of Spectrum K-124-1791-50
Synonyms 8-Thia-2-azatetracyclo[4.3.0.0(3,9).0(4,7)]nonane-5-carbonitrile
Wiley ID 1160023