CID 3056419

73771-47-8

Structural Information

Molecular Formula
C13H19NO
SMILES
CCCC(C1=CC=CC=C1)N2CCOC2
InChI
InChI=1S/C13H19NO/c1-2-6-13(14-9-10-15-11-14)12-7-4-3-5-8-12/h3-5,7-8,13H,2,6,9-11H2,1H3
InChIKey
CBIUWRCDZMEIID-UHFFFAOYSA-N
Compound name
3-(1-phenylbutyl)-1,3-oxazolidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

205.14667 Da
Monoisotopic Mass

2.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 206.15395 148.4
[M+Na]+ 228.13589 153.1
[M-H]- 204.13939 153.3
[M+NH4]+ 223.18049 166.0
[M+K]+ 244.10983 151.9
[M+H-H2O]+ 188.14393 140.7
[M+HCOO]- 250.14487 168.0
[M+CH3COO]- 264.16052 185.1
[M+Na-2H]- 226.12134 151.9
[M]+ 205.14612 146.9
[M]- 205.14722 146.9
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.