CID 109112

Einecs 262-898-2

Structural Information

Molecular Formula
C11H16N4O2
SMILES
C1=CC=C2C(=C1)N=NN2CN(CCO)CCO
InChI
InChI=1S/C11H16N4O2/c16-7-5-14(6-8-17)9-15-11-4-2-1-3-10(11)12-13-15/h1-4,16-17H,5-9H2
InChIKey
WKZLYSXRFUGBPI-UHFFFAOYSA-N
Compound name
2-[benzotriazol-1-ylmethyl(2-hydroxyethyl)amino]ethanol
Related CIDs

2D Structure

compound 2d structure
3
Annotation Hits

0
References

453
Patents

236.12732 Da
Monoisotopic Mass

0.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 237.134596 151.2
[M+Na]+ 259.116538 159.2
[M-H]- 235.120044 150.7
[M+NH4]+ 254.161143 166.8
[M+K]+ 275.090478 156.3
[M+H-H2O]+ 219.124580 142.6
[M+HCOO]- 281.125521 172.2
[M+CH3COO]- 295.141171 191.1
[M+Na-2H]- 257.101986 158.2
[M]+ 236.12677142 154.3
[M]- 236.12786858 154.3
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