CID 11470407

N,n-bis(2-hydroxypropyl)benzamide

Structural Information

Molecular Formula
C13H19NO3
SMILES
CC(CN(CC(C)O)C(=O)C1=CC=CC=C1)O
InChI
InChI=1S/C13H19NO3/c1-10(15)8-14(9-11(2)16)13(17)12-6-4-3-5-7-12/h3-7,10-11,15-16H,8-9H2,1-2H3
InChIKey
ASHCIVHUDUZMEU-UHFFFAOYSA-N
Compound name
N,N-bis(2-hydroxypropyl)benzamide
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

11
Patents

237.13649 Da
Monoisotopic Mass

0.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 238.14377 156.7
[M+Na]+ 260.12571 160.2
[M-H]- 236.12921 158.3
[M+NH4]+ 255.17031 172.9
[M+K]+ 276.09965 159.5
[M+H-H2O]+ 220.13375 150.0
[M+HCOO]- 282.13469 176.3
[M+CH3COO]- 296.15034 193.8
[M+Na-2H]- 258.11116 157.5
[M]+ 237.13594 156.3
[M]- 237.13704 156.3
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