CID 13586013

N-(3-hydroxypropyl)formamide

Structural Information

Molecular Formula
C4H9NO2
SMILES
C(CNC=O)CO
InChI
InChI=1S/C4H9NO2/c6-3-1-2-5-4-7/h4,6H,1-3H2,(H,5,7)
InChIKey
WYRFKDCNTSFHBX-UHFFFAOYSA-N
Compound name
N-(3-hydroxypropyl)formamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

308
Patents

103.06333 Da
Monoisotopic Mass

-0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 104.07061 118.7
[M+Na]+ 126.05255 125.7
[M-H]- 102.05605 117.8
[M+NH4]+ 121.09715 140.8
[M+K]+ 142.02649 125.3
[M+H-H2O]+ 86.060590 114.2
[M+HCOO]- 148.06153 143.3
[M+CH3COO]- 162.07718 166.2
[M+Na-2H]- 124.03800 126.5
[M]+ 103.06278 118.6
[M]- 103.06388 118.6
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