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Tricyclo[3.2.1.0(2,7)]octan-3-one-1-d
SpectraBase Compound ID 5PLtcPuYfVH
InChI InChI=1S/C8H10O/c9-7-3-4-1-5-6(2-4)8(5)7/h4-6,8H,1-3H2/i5D
InChIKey IYDIBEJLJRMFIC-UICOGKGYSA-N
Mol Weight 123.17 g/mol
Molecular Formula C8H9DO
Exact Mass 123.079442 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Cxl7sfnd9mZ
Name Tricyclo[3.2.1.0(2,7)]octan-3-one-1-d
CAS Registry Number 81095-73-0
Comments Less than 3 mono-isotopic peaks
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Formula C8H9DO
InChI InChI=1S/C8H10O/c9-7-3-4-1-5-6(2-4)8(5)7/h4-6,8H,1-3H2/i5D
InChIKey IYDIBEJLJRMFIC-UICOGKGYSA-N
Molecular Weight 123.173 g/mol
SMILES C12(C3CC(C2)CC(C13)=O)[D]
SPLASH splash10-004i-9100000000-b386b538dcdcc8a19183
Source of Spectrum C-104-2465-0
Synonyms 1-Deuteriotricyclo[3.2.1.0]octan-3-one
Wiley ID 1128194