CID 20811826

3-isobutylmorpholine

Structural Information

Molecular Formula
C8H17NO
SMILES
CC(C)CC1COCCN1
InChI
InChI=1S/C8H17NO/c1-7(2)5-8-6-10-4-3-9-8/h7-9H,3-6H2,1-2H3
InChIKey
INIRYZSIQPENMR-UHFFFAOYSA-N
Compound name
3-(2-methylpropyl)morpholine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

142
Patents

143.13101 Da
Monoisotopic Mass

1.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 144.13829 133.5
[M+Na]+ 166.12023 143.7
[M+NH4]+ 161.16483 141.8
[M+K]+ 182.09417 138.5
[M-H]- 142.12373 135.7
[M+Na-2H]- 164.10568 137.4
[M]+ 143.13046 135.4
[M]- 143.13156 135.4
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