CID 11105716

78939-34-1

Structural Information

Molecular Formula
C8H10N2O2
SMILES
COC1=C(C=C(C=C1)N)NC=O
InChI
InChI=1S/C8H10N2O2/c1-12-8-3-2-6(9)4-7(8)10-5-11/h2-5H,9H2,1H3,(H,10,11)
InChIKey
GAPCMYIHVRFISC-UHFFFAOYSA-N
Compound name
N-(5-amino-2-methoxyphenyl)formamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

20
Patents

166.07423 Da
Monoisotopic Mass

0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 167.08151 132.0
[M+Na]+ 189.06345 140.2
[M-H]- 165.06695 135.9
[M+NH4]+ 184.10805 152.1
[M+K]+ 205.03739 138.5
[M+H-H2O]+ 149.07149 125.9
[M+HCOO]- 211.07243 159.0
[M+CH3COO]- 225.08808 182.9
[M+Na-2H]- 187.04890 138.9
[M]+ 166.07368 132.0
[M]- 166.07478 132.0
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe