CID 94728

2-aminobenzhydrazide

Structural Information

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

2D Structure

compound 2d structure
3
Annotation Hits

8
References

967
Patents

151.07455 Da
Monoisotopic Mass

-0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 152.081826 129.5
[M+Na]+ 174.063768 136.2
[M-H]- 150.067274 132.7
[M+NH4]+ 169.108373 149.2
[M+K]+ 190.037708 134.4
[M+H-H2O]+ 134.071810 123.2
[M+HCOO]- 196.072751 155.9
[M+CH3COO]- 210.088401 181.4
[M+Na-2H]- 172.049216 135.5
[M]+ 151.07400142 124.8
[M]- 151.07509858 124.8
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