CID 3044127

2-cyclohexen-1-amine, 4,4-diphenyl-n-methyl-, maleate

Structural Information

Molecular Formula
C19H21N
SMILES
CNC1CCC(C=C1)(C2=CC=CC=C2)C3=CC=CC=C3
InChI
InChI=1S/C19H21N/c1-20-18-12-14-19(15-13-18,16-8-4-2-5-9-16)17-10-6-3-7-11-17/h2-12,14,18,20H,13,15H2,1H3
InChIKey
XCVNMEPAZAQGCH-UHFFFAOYSA-N
Compound name
N-methyl-4,4-diphenylcyclohex-2-en-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

263.1674 Da
Monoisotopic Mass

4.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 264.174676 163.1
[M+Na]+ 286.156618 168.0
[M-H]- 262.160124 172.0
[M+NH4]+ 281.201223 180.6
[M+K]+ 302.130558 162.7
[M+H-H2O]+ 246.164660 154.2
[M+HCOO]- 308.165601 185.3
[M+CH3COO]- 322.181251 174.3
[M+Na-2H]- 284.142066 169.5
[M]+ 263.16685142 158.3
[M]- 263.16794858 158.3
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.