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3,6-Methanocyclopentapyrazol-4(3H)-one, 3a,5,6,6a-tetrahydro-
SpectraBase Compound ID G2X9gTeUwNV
InChI InChI=1S/C7H8N2O/c10-5-2-3-1-4-6(5)7(3)9-8-4/h3-4,6-7H,1-2H2/t3-,4+,6-,7-/m1/s1
InChIKey RXBXJPJXFRWTBC-GFKUXRSRSA-N
Mol Weight 136.15 g/mol
Molecular Formula C7H8N2O
Exact Mass 136.063663 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Ifyel7cCdIj
Name 3,6-Methanocyclopentapyrazol-4(3H)-one, 3a,5,6,6a-tetrahydro-
Alternate Name(s) 4,5-Diazatricyclo[4.3.0.0(3,7)]non-4-en-8-one
CAS Registry Number 81447-75-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H8N2O
InChI InChI=1S/C7H8N2O/c10-5-2-3-1-4-6(5)7(3)9-8-4/h3-4,6-7H,1-2H2/t3-,4+,6-,7-/m1/s1
InChIKey RXBXJPJXFRWTBC-GFKUXRSRSA-N
Molecular Weight 136.154 g/mol
SMILES [C@@]12(N=N[C@]3([C@]2(C(C[C@]3(C1)[H])=O)[H])[H])[H]
SPLASH splash10-014i-9000000000-e9d470e3f3d8c34b1dce
Source of Spectrum K-118-3082-4
Wiley ID 1135903