CID 125280112

2731369-13-2

Structural Information

Molecular Formula
C17H25N
SMILES
CCCCC1=C(CC2=CC=CC=C21)CCN(C)C
InChI
InChI=1S/C17H25N/c1-4-5-9-16-15(11-12-18(2)3)13-14-8-6-7-10-17(14)16/h6-8,10H,4-5,9,11-13H2,1-3H3
InChIKey
QRBCJHCPOPCDIE-UHFFFAOYSA-N
Compound name
2-(3-butyl-1H-inden-2-yl)-N,N-dimethylethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

243.1987 Da
Monoisotopic Mass

4.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 244.20598 160.4
[M+Na]+ 266.18792 172.4
[M+NH4]+ 261.23252 170.2
[M+K]+ 282.16186 165.5
[M-H]- 242.19142 164.5
[M+Na-2H]- 264.17337 166.2
[M]+ 243.19815 163.4
[M]- 243.19925 163.4
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.