CID 114406

10565-74-9

Structural Information

Molecular Formula
C22H29N
SMILES
CC1(CC(C2=CC=CC=C21)(CCCN(C)C)C3=CC=CC=C3)C
InChI
InChI=1S/C22H29N/c1-21(2)17-22(15-10-16-23(3)4,18-11-6-5-7-12-18)20-14-9-8-13-19(20)21/h5-9,11-14H,10,15-17H2,1-4H3
InChIKey
RRHNMFYHZDMVFN-UHFFFAOYSA-N
Compound name
3-(3,3-dimethyl-1-phenyl-2H-inden-1-yl)-N,N-dimethylpropan-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

8
Patents

307.23 Da
Monoisotopic Mass

5.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 308.23728 177.3
[M+Na]+ 330.21922 184.1
[M-H]- 306.22272 185.9
[M+NH4]+ 325.26382 199.4
[M+K]+ 346.19316 179.4
[M+H-H2O]+ 290.22726 169.6
[M+HCOO]- 352.22820 199.7
[M+CH3COO]- 366.24385 213.4
[M+Na-2H]- 328.20467 180.6
[M]+ 307.22945 179.1
[M]- 307.23055 179.1
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