CID 73745649

79313-76-1

Structural Information

Molecular Formula
C19H21N3O
SMILES
CC1(C2=CC=CC=C2N(C1=CN=NC3=CC=CC=C3OC)C)C
InChI
InChI=1S/C19H21N3O/c1-19(2)14-9-5-7-11-16(14)22(3)18(19)13-20-21-15-10-6-8-12-17(15)23-4/h5-13H,1-4H3
InChIKey
FTRUQRHWHCWAMO-UHFFFAOYSA-N
Compound name
(2-methoxyphenyl)-[(1,3,3-trimethylindol-2-ylidene)methyl]diazene
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

3
Patents

307.16846 Da
Monoisotopic Mass

4.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 308.175736 172.4
[M+Na]+ 330.157678 181.6
[M-H]- 306.161184 181.8
[M+NH4]+ 325.202283 192.0
[M+K]+ 346.131618 177.2
[M+H-H2O]+ 290.165720 163.5
[M+HCOO]- 352.166661 198.6
[M+CH3COO]- 366.182311 215.5
[M+Na-2H]- 328.143126 177.3
[M]+ 307.16791142 175.8
[M]- 307.16900858 175.8
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