CID 169651

1-[2-(dodecyloxy)ethyl]pyrrolidine

Structural Information

Molecular Formula
C18H37NO
SMILES
CCCCCCCCCCCCOCCN1CCCC1
InChI
InChI=1S/C18H37NO/c1-2-3-4-5-6-7-8-9-10-13-17-20-18-16-19-14-11-12-15-19/h2-18H2,1H3
InChIKey
ZXQPAHCKMPFMTO-UHFFFAOYSA-N
Compound name
1-(2-dodecoxyethyl)pyrrolidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

11
References

0
Patents

283.2875 Da
Monoisotopic Mass

6.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 284.29478 178.6
[M+Na]+ 306.27672 179.9
[M-H]- 282.28022 177.9
[M+NH4]+ 301.32132 194.6
[M+K]+ 322.25066 176.8
[M+H-H2O]+ 266.28476 170.1
[M+HCOO]- 328.28570 196.7
[M+CH3COO]- 342.30135 204.0
[M+Na-2H]- 304.26217 177.4
[M]+ 283.28695 181.5
[M]- 283.28805 181.5
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.