CID 188973

2,3,4-trihydroxybenzylhydrazine

Structural Information

Molecular Formula
C7H10N2O3
SMILES
C1=CC(=C(C(=C1CNN)O)O)O
InChI
InChI=1S/C7H10N2O3/c8-9-3-4-1-2-5(10)7(12)6(4)11/h1-2,9-12H,3,8H2
InChIKey
BARUGVIPWPSKOJ-UHFFFAOYSA-N
Compound name
4-(hydrazinylmethyl)benzene-1,2,3-triol
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

6
References

23
Patents

170.06914 Da
Monoisotopic Mass

0.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 171.07642 133.0
[M+Na]+ 193.05836 140.8
[M-H]- 169.06186 133.0
[M+NH4]+ 188.10296 150.9
[M+K]+ 209.03230 137.9
[M+H-H2O]+ 153.06640 127.6
[M+HCOO]- 215.06734 155.6
[M+CH3COO]- 229.08299 177.2
[M+Na-2H]- 191.04381 138.0
[M]+ 170.06859 129.4
[M]- 170.06969 129.4
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