CID 33263

25973-55-1

Structural Information

Molecular Formula
C22H29N3O
SMILES
CCC(C)(C)C1=CC(=C(C(=C1)N2N=C3C=CC=CC3=N2)O)C(C)(C)CC
InChI
InChI=1S/C22H29N3O/c1-7-21(3,4)15-13-16(22(5,6)8-2)20(26)19(14-15)25-23-17-11-9-10-12-18(17)24-25/h9-14,26H,7-8H2,1-6H3
InChIKey
ZMWRRFHBXARRRT-UHFFFAOYSA-N
Compound name
2-(benzotriazol-2-yl)-4,6-bis(2-methylbutan-2-yl)phenol
Related CIDs

2D Structure

compound 2d structure
5
Annotation Hits

12
References

30851
Patents

351.23105 Da
Monoisotopic Mass

7.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 352.23833 192.7
[M+Na]+ 374.22027 201.9
[M-H]- 350.22377 195.9
[M+NH4]+ 369.26487 204.6
[M+K]+ 390.19421 195.7
[M+H-H2O]+ 334.22831 183.9
[M+HCOO]- 396.22925 207.5
[M+CH3COO]- 410.24490 216.2
[M+Na-2H]- 372.20572 196.0
[M]+ 351.23050 197.0
[M]- 351.23160 197.0
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