CID 24152678

(cyclobutylmethyl)(1-phenylethyl)amine

Structural Information

Molecular Formula
C13H19N
SMILES
CC(C1=CC=CC=C1)NCC2CCC2
InChI
InChI=1S/C13H19N/c1-11(13-8-3-2-4-9-13)14-10-12-6-5-7-12/h2-4,8-9,11-12,14H,5-7,10H2,1H3
InChIKey
WWHFXZPZKIRVOJ-UHFFFAOYSA-N
Compound name
N-(cyclobutylmethyl)-1-phenylethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

189.15175 Da
Monoisotopic Mass

3.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 190.15903 143.1
[M+Na]+ 212.14097 146.2
[M-H]- 188.14447 148.8
[M+NH4]+ 207.18557 155.6
[M+K]+ 228.11491 146.9
[M+H-H2O]+ 172.14901 130.8
[M+HCOO]- 234.14995 164.6
[M+CH3COO]- 248.16560 190.4
[M+Na-2H]- 210.12642 147.9
[M]+ 189.15120 148.8
[M]- 189.15230 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.