CID 368238

Pyruvamide benzylimine

Structural Information

Molecular Formula
C10H12N2O
SMILES
CC(=O)C(=NCC1=CC=CC=C1)N
InChI
InChI=1S/C10H12N2O/c1-8(13)10(11)12-7-9-5-3-2-4-6-9/h2-6H,7H2,1H3,(H2,11,12)
InChIKey
QNJGFFLMKAKKHP-UHFFFAOYSA-N
Compound name
N'-benzyl-2-oxopropanimidamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

176.09496 Da
Monoisotopic Mass

0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 177.10224 138.7
[M+Na]+ 199.08418 144.4
[M-H]- 175.08768 143.0
[M+NH4]+ 194.12878 158.3
[M+K]+ 215.05812 143.0
[M+H-H2O]+ 159.09222 131.9
[M+HCOO]- 221.09316 164.4
[M+CH3COO]- 235.10881 187.3
[M+Na-2H]- 197.06963 143.8
[M]+ 176.09441 136.9
[M]- 176.09551 136.9
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.