CID 37679

2-(1-methylethyl)-alpha-3-pyridinyl-1h-indole-3-methanimine

Structural Information

Molecular Formula
C17H17N3
SMILES
CC(C)C1=C(C2=CC=CC=C2N1)C(=N)C3=CN=CC=C3
InChI
InChI=1S/C17H17N3/c1-11(2)17-15(13-7-3-4-8-14(13)20-17)16(18)12-6-5-9-19-10-12/h3-11,18,20H,1-2H3
InChIKey
GPERKBZAKJKALC-UHFFFAOYSA-N
Compound name
(2-propan-2-yl-1H-indol-3-yl)-pyridin-3-ylmethanimine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

263.14224 Da
Monoisotopic Mass

3.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 264.149516 161.6
[M+Na]+ 286.131458 169.5
[M-H]- 262.134964 165.8
[M+NH4]+ 281.176063 177.3
[M+K]+ 302.105398 163.2
[M+H-H2O]+ 246.139500 153.1
[M+HCOO]- 308.140441 182.1
[M+CH3COO]- 322.156091 172.8
[M+Na-2H]- 284.116906 165.8
[M]+ 263.14169142 160.2
[M]- 263.14278858 160.2
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.