CID 233611

4-(morpholin-4-yl)butan-1-amine

Structural Information

Molecular Formula
C8H18N2O
SMILES
C1COCCN1CCCCN
InChI
InChI=1S/C8H18N2O/c9-3-1-2-4-10-5-7-11-8-6-10/h1-9H2
InChIKey
DUYYFMPMGYATPO-UHFFFAOYSA-N
Compound name
4-morpholin-4-ylbutan-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

418
Patents

158.1419 Da
Monoisotopic Mass

-0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 159.14918 137.4
[M+Na]+ 181.13112 141.3
[M-H]- 157.13462 138.5
[M+NH4]+ 176.17572 154.8
[M+K]+ 197.10506 141.2
[M+H-H2O]+ 141.13916 130.3
[M+HCOO]- 203.14010 156.3
[M+CH3COO]- 217.15575 178.1
[M+Na-2H]- 179.11657 143.3
[M]+ 158.14135 133.4
[M]- 158.14245 133.4
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