CID 3025395

Fc 465

Structural Information

Molecular Formula
C18H24N2
SMILES
CC(CNCC1=CC=CC=C1)(C2=CC=CC=C2)N(C)C
InChI
InChI=1S/C18H24N2/c1-18(20(2)3,17-12-8-5-9-13-17)15-19-14-16-10-6-4-7-11-16/h4-13,19H,14-15H2,1-3H3
InChIKey
KAVNDXXDQVYJEU-UHFFFAOYSA-N
Compound name
1-N-benzyl-2-N,2-N-dimethyl-2-phenylpropane-1,2-diamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

268.19394 Da
Monoisotopic Mass

3.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 269.20122 165.6
[M+Na]+ 291.18316 169.3
[M-H]- 267.18666 172.7
[M+NH4]+ 286.22776 181.6
[M+K]+ 307.15710 166.2
[M+H-H2O]+ 251.19120 157.1
[M+HCOO]- 313.19214 189.6
[M+CH3COO]- 327.20779 207.7
[M+Na-2H]- 289.16861 172.2
[M]+ 268.19339 165.4
[M]- 268.19449 165.4
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.