CID 577187

N-(3-formylaminomethyl-benzyl)-formamide

Structural Information

Molecular Formula
C10H12N2O2
SMILES
C1=CC(=CC(=C1)CNC=O)CNC=O
InChI
InChI=1S/C10H12N2O2/c13-7-11-5-9-2-1-3-10(4-9)6-12-8-14/h1-4,7-8H,5-6H2,(H,11,13)(H,12,14)
InChIKey
ZUUAKXMTKFCWJM-UHFFFAOYSA-N
Compound name
N-[[3-(formamidomethyl)phenyl]methyl]formamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

37
Patents

192.08987 Da
Monoisotopic Mass

0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 193.097146 139.4
[M+Na]+ 215.079088 146.1
[M-H]- 191.082594 143.0
[M+NH4]+ 210.123693 158.3
[M+K]+ 231.053028 143.6
[M+H-H2O]+ 175.087130 132.7
[M+HCOO]- 237.088071 166.6
[M+CH3COO]- 251.103721 187.6
[M+Na-2H]- 213.064536 147.1
[M]+ 192.08932142 140.0
[M]- 192.09041858 140.0
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

patents stripe