CID 110819

6267-58-9

Structural Information

Molecular Formula
C18H23N
SMILES
CC(C)CNC(CC1=CC=CC=C1)C2=CC=CC=C2
InChI
InChI=1S/C18H23N/c1-15(2)14-19-18(17-11-7-4-8-12-17)13-16-9-5-3-6-10-16/h3-12,15,18-19H,13-14H2,1-2H3
InChIKey
MDCAXCVWFHKLAO-UHFFFAOYSA-N
Compound name
N-(1,2-diphenylethyl)-2-methylpropan-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

253.18304 Da
Monoisotopic Mass

4.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 254.19032 162.8
[M+Na]+ 276.17226 166.2
[M-H]- 252.17576 168.4
[M+NH4]+ 271.21686 178.9
[M+K]+ 292.14620 162.2
[M+H-H2O]+ 236.18030 154.6
[M+HCOO]- 298.18124 184.8
[M+CH3COO]- 312.19689 200.6
[M+Na-2H]- 274.15771 166.6
[M]+ 253.18249 161.3
[M]- 253.18359 161.3
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.