CID 105730

Benzenamine, 2,5-dibutoxy-4-(4-morpholinyl)-

Structural Information

Molecular Formula
C18H30N2O3
SMILES
CCCCOC1=CC(=C(C=C1N)OCCCC)N2CCOCC2
InChI
InChI=1S/C18H30N2O3/c1-3-5-9-22-17-14-16(20-7-11-21-12-8-20)18(13-15(17)19)23-10-6-4-2/h13-14H,3-12,19H2,1-2H3
InChIKey
YOVXTCPXRNWWRF-UHFFFAOYSA-N
Compound name
2,5-dibutoxy-4-morpholin-4-ylaniline
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

28
Patents

322.22565 Da
Monoisotopic Mass

3.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 323.23293 181.6
[M+Na]+ 345.21487 185.1
[M-H]- 321.21837 185.7
[M+NH4]+ 340.25947 192.6
[M+K]+ 361.18881 183.0
[M+H-H2O]+ 305.22291 172.0
[M+HCOO]- 367.22385 199.0
[M+CH3COO]- 381.23950 211.7
[M+Na-2H]- 343.20032 182.5
[M]+ 322.22510 182.6
[M]- 322.22620 182.6
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