CID 3060353

78043-80-8

Structural Information

Molecular Formula
C16H24N2O2
SMILES
CC(C1=CC(=CC=C1)OCCCNC=O)N2CCCC2
InChI
InChI=1S/C16H24N2O2/c1-14(18-9-2-3-10-18)15-6-4-7-16(12-15)20-11-5-8-17-13-19/h4,6-7,12-14H,2-3,5,8-11H2,1H3,(H,17,19)
InChIKey
FRVWYMBOASROEV-UHFFFAOYSA-N
Compound name
N-[3-[3-(1-pyrrolidin-1-ylethyl)phenoxy]propyl]formamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

3
Patents

276.18378 Da
Monoisotopic Mass

2.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 277.191056 167.0
[M+Na]+ 299.172998 170.4
[M-H]- 275.176504 171.1
[M+NH4]+ 294.217603 182.7
[M+K]+ 315.146938 167.4
[M+H-H2O]+ 259.181040 158.3
[M+HCOO]- 321.181981 187.9
[M+CH3COO]- 335.197631 201.3
[M+Na-2H]- 297.158446 168.1
[M]+ 276.18323142 166.4
[M]- 276.18432858 166.4
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

patents stripe