CID 3033039

52371-39-8

Structural Information

Molecular Formula
C18H21N
SMILES
CN(C)[C@H]1CC[C@H](C2=CC=CC=C12)C3=CC=CC=C3
InChI
InChI=1S/C18H21N/c1-19(2)18-13-12-15(14-8-4-3-5-9-14)16-10-6-7-11-17(16)18/h3-11,15,18H,12-13H2,1-2H3/t15-,18-/m0/s1
InChIKey
ZLYGADOSSMOOPG-YJBOKZPZSA-N
Compound name
(1S,4S)-N,N-dimethyl-4-phenyl-1,2,3,4-tetrahydronaphthalen-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

251.1674 Da
Monoisotopic Mass

4.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 252.174676 158.8
[M+Na]+ 274.156618 164.1
[M-H]- 250.160124 166.9
[M+NH4]+ 269.201223 177.0
[M+K]+ 290.130558 160.2
[M+H-H2O]+ 234.164660 150.4
[M+HCOO]- 296.165601 180.2
[M+CH3COO]- 310.181251 170.5
[M+Na-2H]- 272.142066 164.0
[M]+ 251.16685142 156.2
[M]- 251.16794858 156.2
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.