CID 122163726

N-benzyl-5,5-dimethyloxolan-3-amine

Structural Information

Molecular Formula
C13H19NO
SMILES
CC1(CC(CO1)NCC2=CC=CC=C2)C
InChI
InChI=1S/C13H19NO/c1-13(2)8-12(10-15-13)14-9-11-6-4-3-5-7-11/h3-7,12,14H,8-10H2,1-2H3
InChIKey
GSXDTXXZNSUHDR-UHFFFAOYSA-N
Compound name
N-benzyl-5,5-dimethyloxolan-3-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

205.14667 Da
Monoisotopic Mass

2.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 206.153946 146.5
[M+Na]+ 228.135888 152.5
[M-H]- 204.139394 153.6
[M+NH4]+ 223.180493 167.6
[M+K]+ 244.109828 151.0
[M+H-H2O]+ 188.143930 140.4
[M+HCOO]- 250.144871 169.5
[M+CH3COO]- 264.160521 187.1
[M+Na-2H]- 226.121336 152.3
[M]+ 205.14612142 145.1
[M]- 205.14721858 145.1
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.