CID 93629

57303-71-6

Structural Information

Molecular Formula
C19H21N3
SMILES
CC1=CC=C(C=C1)N=NC=C2C(C3=CC=CC=C3N2C)(C)C
InChI
InChI=1S/C19H21N3/c1-14-9-11-15(12-10-14)21-20-13-18-19(2,3)16-7-5-6-8-17(16)22(18)4/h5-13H,1-4H3
InChIKey
QVORMTIMKWYLIM-UHFFFAOYSA-N
Compound name
(4-methylphenyl)-[(1,3,3-trimethylindol-2-ylidene)methyl]diazene
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

291.17355 Da
Monoisotopic Mass

5.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 292.18083 169.1
[M+Na]+ 314.16277 178.6
[M-H]- 290.16627 178.6
[M+NH4]+ 309.20737 189.5
[M+K]+ 330.13671 173.5
[M+H-H2O]+ 274.17081 160.4
[M+HCOO]- 336.17175 195.2
[M+CH3COO]- 350.18740 213.4
[M+Na-2H]- 312.14822 174.0
[M]+ 291.17300 171.2
[M]- 291.17410 171.2
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.