CID 94549203

324034-56-2

Structural Information

Molecular Formula
C15H19N
SMILES
CC(C)(C)[C@@H](C1=CC=CC2=CC=CC=C21)N
InChI
InChI=1S/C15H19N/c1-15(2,3)14(16)13-10-6-8-11-7-4-5-9-12(11)13/h4-10,14H,16H2,1-3H3/t14-/m1/s1
InChIKey
FQTPRCXAYUOOGA-CQSZACIVSA-N
Compound name
(1S)-2,2-dimethyl-1-naphthalen-1-ylpropan-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

213.15175 Da
Monoisotopic Mass

3.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 214.15903 150.4
[M+Na]+ 236.14097 157.1
[M-H]- 212.14447 154.4
[M+NH4]+ 231.18557 170.0
[M+K]+ 252.11491 153.5
[M+H-H2O]+ 196.14901 144.5
[M+HCOO]- 258.14995 170.8
[M+CH3COO]- 272.16560 192.7
[M+Na-2H]- 234.12642 156.8
[M]+ 213.15120 148.8
[M]- 213.15230 148.8
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.