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5-[3H]-N-Formylproline

View entire compound with spectra: 1 MS (GC)

5-[3H]-N-Formylproline
SpectraBase Compound ID HffR80GyzPH
InChI InChI=1S/C6H9NO3/c8-4-7-3-1-2-5(7)6(9)10/h4-5H,1-3H2,(H,9,10)/t5-/m0/s1/i3T/t3?,5-
InChIKey DHDRGOURKDLAOT-WUHWCSGHSA-N
Mol Weight 145.15 g/mol
Molecular Formula C6H83HNO3
Exact Mass 145.066467 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3bODEXT3qeD
Name 5-[3H]-N-Formylproline
Comments Original formula: C6H8[3H]NO3; Note: The molecular formula of the structure shown is C6H8TNO3 - which differs from the formula reported for the mass spectrum (C6H8[3H]NO3)
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Formula C6H9NO3
InChI InChI=1S/C6H9NO3/c8-4-7-3-1-2-5(7)6(9)10/h4-5H,1-3H2,(H,9,10)/t5-/m0/s1/i3T/t3?,5-
InChIKey DHDRGOURKDLAOT-WUHWCSGHSA-N
Molecular Weight 145.150 g/mol
SMILES OC([C@]1(N(C=O)C(CC1)[3H])[H])=O
SPLASH splash10-006t-9000000000-ac9147554530b039869b
Source of Spectrum X2-49-842-15
Wiley ID 1601988