CID 20811826

3-(2-methylpropyl)morpholine

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

208
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 134.2
[M+Na]+ 166.12023 138.2
[M-H]- 142.12373 134.5
[M+NH4]+ 161.16483 152.0
[M+K]+ 182.09417 138.2
[M+H-H2O]+ 126.12827 127.9
[M+HCOO]- 188.12921 150.1
[M+CH3COO]- 202.14486 172.2
[M+Na-2H]- 164.10568 139.0
[M]+ 143.13046 129.4
[M]- 143.13156 129.4
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