CID 14551849

3,3-dimethylmorpholine

Structural Information

Molecular Formula
C6H13NO
SMILES
CC1(COCCN1)C
InChI
InChI=1S/C6H13NO/c1-6(2)5-8-4-3-7-6/h7H,3-5H2,1-2H3
InChIKey
HEYGLTRAXBZNAD-UHFFFAOYSA-N
Compound name
3,3-dimethylmorpholine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1619
Patents

115.09972 Da
Monoisotopic Mass

0.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 116.10700 123.7
[M+Na]+ 138.08894 129.8
[M-H]- 114.09244 124.8
[M+NH4]+ 133.13354 144.9
[M+K]+ 154.06288 130.2
[M+H-H2O]+ 98.096980 118.7
[M+HCOO]- 160.09792 141.4
[M+CH3COO]- 174.11357 164.8
[M+Na-2H]- 136.07439 132.1
[M]+ 115.09917 119.2
[M]- 115.10027 119.2
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