CID 456783

2oh4nphcon2 me2

Structural Information

Molecular Formula
C10H13N3O2
SMILES
CC(=NNC(=O)C1=C(C=C(C=C1)N)O)C
InChI
InChI=1S/C10H13N3O2/c1-6(2)12-13-10(15)8-4-3-7(11)5-9(8)14/h3-5,14H,11H2,1-2H3,(H,13,15)
InChIKey
SASUEBBJPFNJHP-UHFFFAOYSA-N
Compound name
4-amino-2-hydroxy-N-(propan-2-ylideneamino)benzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

207.10077 Da
Monoisotopic Mass

1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 208.10805 145.8
[M+Na]+ 230.08999 152.1
[M-H]- 206.09349 149.4
[M+NH4]+ 225.13459 163.7
[M+K]+ 246.06393 150.5
[M+H-H2O]+ 190.09803 139.0
[M+HCOO]- 252.09897 171.2
[M+CH3COO]- 266.11462 194.0
[M+Na-2H]- 228.07544 149.2
[M]+ 207.10022 143.5
[M]- 207.10132 143.5
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

No patent data available for this compound.