CID 294574

5807-11-4

Structural Information

Molecular Formula
C8H14N2O
SMILES
C1COCCN1CCCC#N
InChI
InChI=1S/C8H14N2O/c9-3-1-2-4-10-5-7-11-8-6-10/h1-2,4-8H2
InChIKey
DNHBZJPTXSALLZ-UHFFFAOYSA-N
Compound name
4-morpholin-4-ylbutanenitrile
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

80
Patents

154.11061 Da
Monoisotopic Mass

-0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 155.11789 127.8
[M+Na]+ 177.09983 134.8
[M-H]- 153.10333 129.1
[M+NH4]+ 172.14443 144.0
[M+K]+ 193.07377 134.1
[M+H-H2O]+ 137.10787 114.5
[M+HCOO]- 199.10881 143.3
[M+CH3COO]- 213.12446 188.1
[M+Na-2H]- 175.08528 134.7
[M]+ 154.11006 120.9
[M]- 154.11116 120.9
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

patents stripe