CID 5916

54-88-6

Structural Information

Molecular Formula
C15H17N3
SMILES
CC1=C(C=CC(=C1)N(C)C)N=NC2=CC=CC=C2
InChI
InChI=1S/C15H17N3/c1-12-11-14(18(2)3)9-10-15(12)17-16-13-7-5-4-6-8-13/h4-11H,1-3H3
InChIKey
QXTOLYZIJUDOIT-UHFFFAOYSA-N
Compound name
N,N,3-trimethyl-4-phenyldiazenylaniline
Related CIDs

2D Structure

compound 2d structure
3
Annotation Hits

12
References

65
Patents

239.14224 Da
Monoisotopic Mass

4.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 240.149516 155.0
[M+Na]+ 262.131458 161.8
[M-H]- 238.134964 165.9
[M+NH4]+ 257.176063 173.8
[M+K]+ 278.105398 160.2
[M+H-H2O]+ 222.139500 146.0
[M+HCOO]- 284.140441 185.7
[M+CH3COO]- 298.156091 209.1
[M+Na-2H]- 260.116906 162.3
[M]+ 239.14169142 157.3
[M]- 239.14278858 157.3
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