CID 4584871

3,3,5,5-tetramethylmorpholine

Structural Information

Molecular Formula
C8H17NO
SMILES
CC1(COCC(N1)(C)C)C
InChI
InChI=1S/C8H17NO/c1-7(2)5-10-6-8(3,4)9-7/h9H,5-6H2,1-4H3
InChIKey
YCSHCQUVDDBCFR-UHFFFAOYSA-N
Compound name
3,3,5,5-tetramethylmorpholine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

108
Patents

143.13101 Da
Monoisotopic Mass

0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 144.13829 130.1
[M+Na]+ 166.12023 137.3
[M-H]- 142.12373 131.7
[M+NH4]+ 161.16483 152.5
[M+K]+ 182.09417 137.5
[M+H-H2O]+ 126.12827 125.9
[M+HCOO]- 188.12921 147.2
[M+CH3COO]- 202.14486 171.8
[M+Na-2H]- 164.10568 138.0
[M]+ 143.13046 127.1
[M]- 143.13156 127.1
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