CID 379086

Nsc663299

Structural Information

Molecular Formula
C18H20N2
SMILES
C1CN(C2=CC=CC=C21)CCN3CCC4=CC=CC=C43
InChI
InChI=1S/C18H20N2/c1-3-7-17-15(5-1)9-11-19(17)13-14-20-12-10-16-6-2-4-8-18(16)20/h1-8H,9-14H2
InChIKey
GOVGXMFTKMWFCG-UHFFFAOYSA-N
Compound name
1-[2-(2,3-dihydroindol-1-yl)ethyl]-2,3-dihydroindole
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

7
References

4
Patents

264.16266 Da
Monoisotopic Mass

3.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 265.16994 163.3
[M+Na]+ 287.15188 170.6
[M-H]- 263.15538 168.7
[M+NH4]+ 282.19648 182.6
[M+K]+ 303.12582 164.8
[M+H-H2O]+ 247.15992 154.5
[M+HCOO]- 309.16086 182.0
[M+CH3COO]- 323.17651 174.6
[M+Na-2H]- 285.13733 165.3
[M]+ 264.16211 161.8
[M]- 264.16321 161.8
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