CID 113189

63402-26-6

Structural Information

Molecular Formula
C7H9N3O
SMILES
C1=CC(=CC=C1N)NNC=O
InChI
InChI=1S/C7H9N3O/c8-6-1-3-7(4-2-6)10-9-5-11/h1-5,10H,8H2,(H,9,11)
InChIKey
JIJNOXGGMCEUMF-UHFFFAOYSA-N
Compound name
N-(4-aminoanilino)formamide
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

125
Patents

151.07455 Da
Monoisotopic Mass

0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 152.08183 127.7
[M+Na]+ 174.06377 134.6
[M-H]- 150.06727 131.2
[M+NH4]+ 169.10837 147.7
[M+K]+ 190.03771 132.5
[M+H-H2O]+ 134.07181 121.3
[M+HCOO]- 196.07275 155.7
[M+CH3COO]- 210.08840 181.8
[M+Na-2H]- 172.04922 136.1
[M]+ 151.07400 124.7
[M]- 151.07510 124.7
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