CID 114404

1-indanethylamine, n,3-dimethyl-1-phenyl-, hydrochloride

Structural Information

Molecular Formula
C19H23N
SMILES
CC1CC(C2=CC=CC=C12)(CCNC)C3=CC=CC=C3
InChI
InChI=1S/C19H23N/c1-15-14-19(12-13-20-2,16-8-4-3-5-9-16)18-11-7-6-10-17(15)18/h3-11,15,20H,12-14H2,1-2H3
InChIKey
GKARHYFGWWJNGI-UHFFFAOYSA-N
Compound name
N-methyl-2-(3-methyl-1-phenyl-2,3-dihydroinden-1-yl)ethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

265.18304 Da
Monoisotopic Mass

4.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 266.190316 164.1
[M+Na]+ 288.172258 171.1
[M-H]- 264.175764 171.5
[M+NH4]+ 283.216863 185.3
[M+K]+ 304.146198 165.5
[M+H-H2O]+ 248.180300 156.8
[M+HCOO]- 310.181241 187.1
[M+CH3COO]- 324.196891 176.2
[M+Na-2H]- 286.157706 168.8
[M]+ 265.18249142 163.4
[M]- 265.18358858 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

patents stripe