CID 313973

2-hydroxymethyl-benzoic acid hydrazide

Structural Information

Molecular Formula
C8H10N2O2
SMILES
C1=CC=C(C(=C1)CO)C(=O)NN
InChI
InChI=1S/C8H10N2O2/c9-10-8(12)7-4-2-1-3-6(7)5-11/h1-4,11H,5,9H2,(H,10,12)
InChIKey
PYUGZJQHOZAYRK-UHFFFAOYSA-N
Compound name
2-(hydroxymethyl)benzohydrazide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

2
References

11
Patents

166.07423 Da
Monoisotopic Mass

-1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 167.08151 133.6
[M+Na]+ 189.06345 140.2
[M-H]- 165.06695 135.7
[M+NH4]+ 184.10805 152.6
[M+K]+ 205.03739 138.1
[M+H-H2O]+ 149.07149 127.5
[M+HCOO]- 211.07243 158.0
[M+CH3COO]- 225.08808 179.5
[M+Na-2H]- 187.04890 139.3
[M]+ 166.07368 130.5
[M]- 166.07478 130.5
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