CID 469924

2-[ethyl-[2-(isopropylamino)ethyl]amino]butan-1-ol

Structural Information

Molecular Formula
C11H26N2O
SMILES
CCC(CO)N(CC)CCNC(C)C
InChI
InChI=1S/C11H26N2O/c1-5-11(9-14)13(6-2)8-7-12-10(3)4/h10-12,14H,5-9H2,1-4H3
InChIKey
QRMZGSLDSWLIBB-UHFFFAOYSA-N
Compound name
2-[ethyl-[2-(propan-2-ylamino)ethyl]amino]butan-1-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

202.20451 Da
Monoisotopic Mass

1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 203.21179 155.1
[M+Na]+ 225.19373 157.7
[M-H]- 201.19723 154.5
[M+NH4]+ 220.23833 173.5
[M+K]+ 241.16767 158.0
[M+H-H2O]+ 185.20177 148.7
[M+HCOO]- 247.20271 176.4
[M+CH3COO]- 261.21836 196.6
[M+Na-2H]- 223.17918 155.8
[M]+ 202.20396 156.0
[M]- 202.20506 156.0
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

No patent data available for this compound.