CID 6410637

Cm 30096

Structural Information

Molecular Formula
C14H17N3O
SMILES
CC1=CC(=NN=C1NCC(C)O)C2=CC=CC=C2
InChI
InChI=1S/C14H17N3O/c1-10-8-13(12-6-4-3-5-7-12)16-17-14(10)15-9-11(2)18/h3-8,11,18H,9H2,1-2H3,(H,15,17)
InChIKey
KULOLNRPJCOHFT-UHFFFAOYSA-N
Compound name
1-[(4-methyl-6-phenylpyridazin-3-yl)amino]propan-2-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

20
Patents

243.13716 Da
Monoisotopic Mass

2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 244.144436 156.8
[M+Na]+ 266.126378 163.7
[M-H]- 242.129884 159.6
[M+NH4]+ 261.170983 170.5
[M+K]+ 282.100318 159.4
[M+H-H2O]+ 226.134420 147.8
[M+HCOO]- 288.135361 177.2
[M+CH3COO]- 302.151011 194.9
[M+Na-2H]- 264.111826 162.3
[M]+ 243.13661142 155.9
[M]- 243.13770858 155.9
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

patents stripe