CID 9665343

1585960-54-8

Structural Information

Molecular Formula
C9H13N3O
SMILES
CN(C)C1=CC=C(C=C1)/C(=N/O)/N
InChI
InChI=1S/C9H13N3O/c1-12(2)8-5-3-7(4-6-8)9(10)11-13/h3-6,13H,1-2H3,(H2,10,11)
InChIKey
NLVACMKNLOCQRQ-UHFFFAOYSA-N
Compound name
4-(dimethylamino)-N'-hydroxybenzenecarboximidamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

9
Patents

179.10587 Da
Monoisotopic Mass

1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 180.11315 139.0
[M+Na]+ 202.09509 144.9
[M-H]- 178.09859 143.8
[M+NH4]+ 197.13969 158.5
[M+K]+ 218.06903 144.4
[M+H-H2O]+ 162.10313 132.1
[M+HCOO]- 224.10407 165.9
[M+CH3COO]- 238.11972 191.5
[M+Na-2H]- 200.08054 144.1
[M]+ 179.10532 137.2
[M]- 179.10642 137.2
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