CID 136522

696-57-1

Structural Information

Molecular Formula
C7H13NO
SMILES
C=CCN1CCOCC1
InChI
InChI=1S/C7H13NO/c1-2-3-8-4-6-9-7-5-8/h2H,1,3-7H2
InChIKey
SUSANAYXICMXBL-UHFFFAOYSA-N
Compound name
4-prop-2-enylmorpholine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

2
References

1772
Patents

127.09972 Da
Monoisotopic Mass

0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 128.10700 126.8
[M+Na]+ 150.08894 132.3
[M-H]- 126.09244 128.7
[M+NH4]+ 145.13354 146.0
[M+K]+ 166.06288 132.5
[M+H-H2O]+ 110.09698 120.5
[M+HCOO]- 172.09792 145.9
[M+CH3COO]- 186.11357 170.1
[M+Na-2H]- 148.07439 134.1
[M]+ 127.09917 123.5
[M]- 127.10027 123.5
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

patents stripe