CID 10607787

3-methyl-4-morpholinoaniline

Structural Information

Molecular Formula
C11H16N2O
SMILES
CC1=C(C=CC(=C1)N)N2CCOCC2
InChI
InChI=1S/C11H16N2O/c1-9-8-10(12)2-3-11(9)13-4-6-14-7-5-13/h2-3,8H,4-7,12H2,1H3
InChIKey
KNOTXXUXSBIPQW-UHFFFAOYSA-N
Compound name
3-methyl-4-morpholin-4-ylaniline
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

173
Patents

192.12627 Da
Monoisotopic Mass

1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 193.133546 143.7
[M+Na]+ 215.115488 149.8
[M-H]- 191.118994 148.9
[M+NH4]+ 210.160093 160.0
[M+K]+ 231.089428 148.1
[M+H-H2O]+ 175.123530 135.9
[M+HCOO]- 237.124471 163.2
[M+CH3COO]- 251.140121 185.1
[M+Na-2H]- 213.100936 149.1
[M]+ 192.12572142 139.1
[M]- 192.12681858 139.1
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