CID 27019

15083-50-8

Structural Information

Molecular Formula
C15H21N3O2
SMILES
CC1=NN(C(=C1)OCCN(C)CCO)C2=CC=CC=C2
InChI
InChI=1S/C15H21N3O2/c1-13-12-15(20-11-9-17(2)8-10-19)18(16-13)14-6-4-3-5-7-14/h3-7,12,19H,8-11H2,1-2H3
InChIKey
AJMCZFKEQAVFPW-UHFFFAOYSA-N
Compound name
2-[methyl-[2-(5-methyl-2-phenylpyrazol-3-yl)oxyethyl]amino]ethanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

275.1634 Da
Monoisotopic Mass

1.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 276.17068 164.6
[M+Na]+ 298.15262 171.1
[M-H]- 274.15612 168.7
[M+NH4]+ 293.19722 179.6
[M+K]+ 314.12656 168.5
[M+H-H2O]+ 258.16066 155.3
[M+HCOO]- 320.16160 187.3
[M+CH3COO]- 334.17725 202.3
[M+Na-2H]- 296.13807 167.5
[M]+ 275.16285 168.1
[M]- 275.16395 168.1
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.