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

159
Patents

151.07455 Da
Monoisotopic Mass

0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 152.081826 127.7
[M+Na]+ 174.063768 134.6
[M-H]- 150.067274 131.2
[M+NH4]+ 169.108373 147.7
[M+K]+ 190.037708 132.5
[M+H-H2O]+ 134.071810 121.3
[M+HCOO]- 196.072751 155.7
[M+CH3COO]- 210.088401 181.8
[M+Na-2H]- 172.049216 136.1
[M]+ 151.07400142 124.7
[M]- 151.07509858 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