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Bicyclo[2.2.1]hept-5-en-2-one-5-D
SpectraBase Compound ID GhchpTWd99i
InChI InChI=1S/C7H8O/c8-7-4-5-1-2-6(7)3-5/h1-2,5-6H,3-4H2/t5-,6+/m1/s1/i1D
InChIKey HUQXEIFQYCVOPD-MOIJHIEOSA-N
Mol Weight 109.15 g/mol
Molecular Formula C7H7DO
Exact Mass 109.063792 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IW3XAohIOcg
Name Bicyclo[2.2.1]hept-5-en-2-one-5-D
Alternate Name(s) (5-Deuterio)bicyclo[2.2.1]hept-5-en-2-one
CAS Registry Number 126497-45-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H7DO
InChI InChI=1S/C7H8O/c8-7-4-5-1-2-6(7)3-5/h1-2,5-6H,3-4H2/t5-,6+/m1/s1/i1D
InChIKey HUQXEIFQYCVOPD-MOIJHIEOSA-N
Molecular Weight 109.146 g/mol
SMILES C1([C@]2(C=C([C@@](C1)(C2)[H])[D])[H])=O
SPLASH splash10-014i-9000000000-2071fe5187f077a38dc0
Source of Spectrum H-72-1026-47
Wiley ID 1121881