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(3aRS,4SR,6aSR)-4-butyl-4,6a-dihydro-3H-cis-furo[3,4-c]pyrazol-6(3aH)-one
SpectraBase Compound ID ICVm0BdJjFi
InChI InChI=1S/C9H14N2O2/c1-2-3-4-7-6-5-10-11-8(6)9(12)13-7/h6-8H,2-5H2,1H3
InChIKey LWFLQENYZNVRMK-UHFFFAOYSA-N
Mol Weight 182.22 g/mol
Molecular Formula C9H14N2O2
Exact Mass 182.105528 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8e6KxaT0Hlt
Name (3aRS,4SR,6aSR)-4-butyl-4,6a-dihydro-3H-cis-furo[3,4-c]pyrazol-6(3aH)-one
CAS Registry Number 126126-94-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H14N2O2
InChI InChI=1S/C9H14N2O2/c1-2-3-4-7-6-5-10-11-8(6)9(12)13-7/h6-8H,2-5H2,1H3
InChIKey LWFLQENYZNVRMK-UHFFFAOYSA-N
Molecular Weight 182.223 g/mol
SMILES C12C(OC(C2CN=N1)CCCC)=O
SPLASH splash10-0002-9100000000-9a8f58d149c3b009e72d
Source of Spectrum H-72-1368-11
Synonyms 4-Butyl-3,3a,4,6a-tetrahydro-6H-furo[3,4-c]pyrazol-6-one
Wiley ID 1178252